SCHEMBL2045834

SCHEMBL2045834

Nc1cccc2c1COC2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.47
MAOA P21397 2/20 0.47
PARP1 P09874 2/20 0.46
ALDH1A1 P00352 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
KDM4E B2RXH2 1/20 0.44
TYMS P04818 1/20 0.44
CYP1A2 P05177 1/20 0.44
HPGD P15428 1/20 0.44
CYP2C19 P33261 1/20 0.44
HSD17B10 Q99714 1/20 0.44
KCNJ1 P48048 3/20 0.43
PTPRC P08575 1/20 0.39
ADORA2A P29274 1/20 0.39
KCNH2 Q12809 2/20 0.37
PRF1 P14222 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
TYR P14679 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30991499 1.00 MAOB (0.47) MAOBMAOAPARP1ALDH1A1LMNA
Toluene SCHEMBL27962797 0.88 KCNJ1 (0.43) MAOBMAOAPARP1ALDH1A1LMNA
SCHEMBL4141000 0.80 PARP1 (0.51) MAOBMAOAPARP1ALDH1A1LMNA
SCHEMBL29568743 0.75 KCNJ1 (0.51) MAOBMAOAPARP1ALDH1A1LMNA
SCHEMBL78594 0.75 MAOB (0.47) MAOBMAOAPARP1ALDH1A1LMNA
SCHEMBL87504 0.75 MAOB (0.47) MAOBMAOAALDH1A1LMNAGAA
SCHEMBL29504833 0.75 MAOB (0.47) MAOBMAOAALDH1A1LMNAGAA
SCHEMBL856025 0.75 MAOB (0.47) MAOBMAOAALDH1A1LMNAGAA
SCHEMBL7639394 0.75 KCNJ1 (0.51) MAOBMAOAPARP1ALDH1A1LMNA
SCHEMBL698199 0.75 PIM1 (0.48) MAOBMAOAALDH1A1LMNAGAA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 67 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118420576-A Amino acid-like guided phthalide analogues and uses thereof 河南农业大学 2024-08-02 CN claimed
CN-117285491-A Amino acid-like guided phthalide analogues and uses thereof 河南农业大学 2023-12-26 CN claimed
CN-118420576-A Amino acid-like guided phthalide analogues and uses thereof 河南农业大学 2024-08-02 CN disclosed
CN-117285491-A Amino acid-like guided phthalide analogues and uses thereof 河南农业大学 2023-12-26 CN disclosed
CN-115403959-A Preparation method of colorful resin coating stock solution with polarity difference 扬州市祥华新材料科技有限公司 2022-11-29 CN disclosed
US-11364241-B2 Dihydropyridophthalazinone inhibitors of poly(ADP-ribose)polymerase (PARP) MEDIVATION TECHNOLOGIES LLC (US) 2022-06-21 US disclosed
US-20210069191-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) MEDIVATION TECHNOLOGIES LLC 2021-03-11 US disclosed
US-10780088-B2 Dihydropyridophthalazinone inhibitors of poly(ADP-ribose)polymerase (PARP) MEDIVATION TECHNOLOGIES LLC (US) 2020-09-22 US disclosed
US-20200261454-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) MEDIVATION TECHNOLOGIES LLC 2020-08-20 US disclosed
US-10543209-B2 Dihydropyridophthalazinone inhibitors of poly(ADP-ribose)polymerase (PARP) MEDIVATION TECHNOLOGIES LLC (US) 2020-01-28 US disclosed
US-20190070189-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) FOR USE IN TREATMENT OF DISEASES ASSOCIATED WITH A PTEN DEFICIENCY BIOMARIN PHARMACEUTICAL INC. 2019-03-07 US disclosed
EP-1670458-A1 1-AMINO-2-OXY-SUBSTITUTED TETRAHYDRONAPHTALENE DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, AND THEIR USE AS ANTIPHLOGISTICS SCHERING AKTIENGESELLSCHAFT (DE) 2006-06-21 EP disclosed
US-20050272823-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-12-08 US disclosed
US-6960468-B2 Preparing a hydrophobic copolymer in a solvent to obtain a solution of hydrophobic copolymer; coating solution of hydrophobic copolymer onto a substrate; removing solvent INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2005-11-01 US disclosed
US-20050209324-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-09-22 US disclosed
US-20050171109-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-08-04 US disclosed
WO-2005034939-A1 1-AMINO-2-OXY-SUBSTITUTED TETRAHYDRONAPHTALENE DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF, AND THEIR USE AS ANTIPHLOGISTICS SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-21 WO disclosed
US-20040062854-A1 On-spot Hydrophilic enhanced slide and preparation thereof INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2004-04-01 US disclosed
US-20020122875-A1 On-spot hydrophilic enhanced slide and preparation thereof JAN BOR-IUAN (TW) 2002-09-05 US disclosed
US-6403368-B1 MALEIMIDE-STYRENE COPOLYMER INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2002-06-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040062854-A1 On-spot Hydrophilic enhanced slide and preparation thereof STUB1, PCNA, MKI67 MAOB 1583/4885MAOA 2012/4885PARP1 4347/4885
US-10780088-B2 Dihydropyridophthalazinone inhibitors of poly(ADP-ribose)polymerase (PARP) PARP1, PARP2, PARP11 MAOB 417/4885MAOA 598/4885PARP1 1/4885
US-20190070189-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) FOR USE IN TREATMENT OF DISEASES ASSOCIATED WITH A PTEN DEFICIENCY PARP1, PARP2, PARP11 MAOB 574/4885MAOA 850/4885PARP1 1/4885
US-11364241-B2 Dihydropyridophthalazinone inhibitors of poly(ADP-ribose)polymerase (PARP) PARP1, PARP2, PARP11 MAOB 417/4885MAOA 598/4885PARP1 1/4885
US-10543209-B2 Dihydropyridophthalazinone inhibitors of poly(ADP-ribose)polymerase (PARP) PARP1, PARP2, PARP11 MAOB 417/4885MAOA 598/4885PARP1 1/4885
US-20050171109-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents TNF, DHPS, PTGES MAOB 1704/4885MAOA 1649/4885PARP1 1092/4885
US-20050272823-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents DHPS, TNF, PTGES MAOB 1097/4885MAOA 1127/4885PARP1 1048/4885
US-20050209324-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents TNF, DHPS, PTGES MAOB 1704/4885MAOA 1649/4885PARP1 1092/4885
US-20200261454-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) PARP1, PARP2, PARP11 MAOB 417/4885MAOA 598/4885PARP1 1/4885
US-20210069191-A1 DIHYDROPYRIDOPHTHALAZINONE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) PARP1, PARP2, PARP11 MAOB 417/4885MAOA 598/4885PARP1 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.