SCHEMBL628270

SCHEMBL628270

[c]1nc2ccccc2cc1-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
GLA P06280 2/20 0.43
HPGD P15428 2/20 0.43
ACHE P22303 2/20 0.43
MAPT P10636 1/20 0.43
PDE10A Q9Y233 1/20 0.43
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
NQO2 P16083 1/20 0.37
KDM4E B2RXH2 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
LMNA P02545 2/20 0.36
KMT2A Q03164 2/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
PTBP1 P26599 1/20 0.36
RAB9A P51151 1/20 0.36
RCE1 Q9Y256 1/20 0.36

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
SCHEMBL7914703 0.87 PDGFRB (0.50) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL1217656 0.83 GSTP1 (0.40) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL6948594 0.82 PDGFRB (0.53) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL7374427 0.79 ADORA2A (0.41) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL9089858 0.79 PDGFRB (0.39) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL1385432 0.77 ALDH1A1 (0.42) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL523809 0.76 RAB9A (0.44) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL641339 0.75 ALDH1A1 (0.47) ALDH1A1GLAHPGDACHEMAPT
SCHEMBL2320187 0.74 KDM4E (0.47) ALDH1A1HPGDMAPTKDM4EL3MBTL1
SCHEMBL2278930 0.74 NPC1 (0.51) ALDH1A1GLAHPGDACHEMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024119977-A1 ORGANIC COMPOUND AND ORGANIC LIGHT EMISSION DIODE DEVICE COMPRISING SAME 四川阿格瑞新材料有限公司 2024-06-13 WO claimed
US-20230276705-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2023-08-31 US claimed
CN-116574131-A Electron transport material and application thereof in electroluminescent device 四川阿格瑞新材料有限公司 2023-08-11 CN claimed
US-11690291-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2023-06-27 US claimed
CN-115117267-A Organic electroluminescent device and display device 云谷(固安)科技有限公司 2022-09-27 CN claimed
CN-110970570-B Organic electroluminescent device 乐金显示有限公司 2022-08-12 CN claimed
EP-3633752-B1 ORGANIC ELECTROLUMINESCENCE DEVICE LG DISPLAY CO LTD (KR) 2021-12-22 EP claimed
US-20210074928-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2021-03-11 US claimed
CN-112409351-A Organic compound, and organic light emitting diode and organic light emitting display device including the same 乐金显示有限公司 2021-02-26 CN claimed
EP-3633752-A1 ORGANIC ELECTROLUMINESCENCE DEVICE LG Display Co., Ltd. (KR) 2020-04-08 EP claimed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP claimed
JP-2007515442-A 2007-06-14 JP claimed
US-7183280-B2 Bicyclic imidazole derivatives, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-02-27 US claimed
EP-1709049-A1 BICYCLIC IMIDAZOLE COMPOUNDS, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2006-10-11 EP claimed
WO-2005063750-A1 BICYCLIC IMIDAZOLE COMPOUNDS, THE PRODUCTION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-07-14 WO claimed
US-20050143377-A1 Bicyclic imidazole derivatives, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-06-30 US claimed
EP-0611003-B1 Substituted phenyl sulfonamides as selective B3 agonists for the treatment of diabetes and obesity MERCK & CO INC (US) 1997-06-18 EP claimed
US-5451677-A Substituted phenyl sulfonamides as selective β 3 agonists for the treatment of diabetes and obesity MERCK & CO., INC. (US) 1995-09-19 US claimed
WO-1994018161-A1 SUBSTITUTED PHENYL SULFONAMIDES AS SELECTIVE β3 AGONISTS FOR THE TREATMENT OF DIABETES AND OBESITY MERCK & CO., INC. (US) 1994-08-18 WO claimed
EP-0611003-A1 Substituted phenyl sulfonamides as selective B3 agonists for the treatment of diabetes and obesity MERCK & CO. INC. (US) 1994-08-17 EP claimed

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

For each of this compound's patents that has machine-readable text (4 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-20050143377-A1 Bicyclic imidazole derivatives, the preparation thereof and their use as pharmaceutical compositions DPP4, DPP3, DPP7 ALDH1A1 434/4885GLA 1844/4885HPGD 2313/4885
US-11690291-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 ALDH1A1 51/4885GLA 1916/4885HPGD 2250/4885
US-20230276705-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 ALDH1A1 51/4885GLA 1916/4885HPGD 2250/4885
US-20210074928-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 ALDH1A1 51/4885GLA 1916/4885HPGD 2250/4885

“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.