SCHEMBL4006491

SCHEMBL4006491

CC(=O)c1ccccc1OCC(=O)O

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.64
KDM4E B2RXH2 4/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
ALDH1A1 P00352 3/20 0.64
L3MBTL1 Q9Y468 3/20 0.62
POLB P06746 1/20 0.62
GLA P06280 1/20 0.62
PTGDR2 Q9Y5Y4 3/20 0.61
HTT P42858 1/20 0.54
HPGD P15428 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
MAPT P10636 2/20 0.54
ALOX15 P16050 1/20 0.52
ABCB1 P08183 1/20 0.50

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
SCHEMBL9331793 0.86 L3MBTL1 (0.59) LMNAKDM4ESMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL10742425 0.86 LMNA (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL29502958 0.85 KDM4E (0.73) KDM4ESMN1; SMN2ALDH1A1L3MBTL1POLB
SCHEMBL8414408 0.85 L3MBTL1 (0.61) KDM4ESMN1; SMN2ALDH1A1L3MBTL1POLB
SCHEMBL341639 0.85 KDM4E (0.73) KDM4ESMN1; SMN2ALDH1A1L3MBTL1POLB
SCHEMBL11100909 0.84 HTT (0.72) LMNAKDM4ESMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL10966260 0.84 LMNA (0.62) LMNAKDM4ESMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL9979663 0.84 LMNA (0.62) LMNAKDM4ESMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL1280991 0.82 POLB (0.64) LMNAKDM4ESMN1; SMN2ALDH1A1L3MBTL1
SCHEMBL7823764 0.82 L3MBTL1 (0.64) KDM4ESMN1; SMN2ALDH1A1L3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11498926-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE CORPORATION (US) 2022-11-15 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-110179777-B Pharmaceutical compositions comprising nitroxyl donors 卡尔迪奥克斯尔制药公司 2022-07-15 CN disclosed
US-11304924-B2 Pharmaceutical compositions comprising nitroxyl donors CARDIOXYL PHARMACEUTICALS, INC. (US) 2022-04-19 US disclosed
EP-3581576-B1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS FOR USE IN THE TREATMENT OF A PROLIFERATIVE DISEASE IN COMBINATION WITH A JANUS KINASE INHIBITOR INCYTE HOLDINGS CORP (US) 2022-01-26 EP disclosed
EP-3427728-B1 PHARMACEUTICAL COMPOSITIONS COMPRISING NITROXYL DONORS CARDIOXYL PHARMACEUTICALS INC (US) 2021-07-07 EP disclosed
US-20210188872-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS INCYTE CORPORTION 2021-06-24 US disclosed
US-10919912-B2 Tricyclic heterocycles as BET protein inhibitors INCYTE HOLDINGS CORPORATION (US) 2021-02-16 US disclosed
US-20200339570-A1 BICYCLIC DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2020-10-29 US disclosed
CN-111518063-A Method for preparing benzofuran from furan by one-step method 中国科学技术大学 2020-08-11 CN disclosed
WO-2009085256-A1 ANTI-HIV COMPOUNDS PANACOS PHARMACEUTICALS, INC. (US) 2009-07-09 WO disclosed
WO-2009085256-A1 ANTI-HIV COMPOUNDS PANACOS PHARMACEUTICALS, INC. (US) 2009-07-09 WO disclosed
US-7335466-B2 Silver salt photothermographic dry imaging material, image recording method and image forming method for the same KONICA MINOLTA HOLDINGS, INC. (JP) 2008-02-26 US disclosed
US-7335466-B2 Silver salt photothermographic dry imaging material, image recording method and image forming method for the same KONICA MINOLTA HOLDINGS, INC. (JP) 2008-02-26 US disclosed
EP-0025109-B1 1-BENZOXEPIN-5(2H)-ONE DERIVATIVES AND THEIR SALTS, AND PROCESSES FOR THEIR PREPARATION Kali-Chemie Pharma GmbH (DE) 1985-05-15 EP disclosed
EP-0074121-B1 2,3,4,5-TETRAHYDRO-1-BENZOXEPINE-3,5-DIONE DERIVATIVES AND PROCESS FOR THEIR PREPARATION Kali-Chemie Pharma GmbH (DE) 1985-04-10 EP disclosed
EP-0074121-A1 2,3,4,5-Tetrahydro-1-benzoxepine-3,5-dione derivatives and process for their preparation Kali-Chemie Pharma GmbH (DE) 1983-03-16 EP disclosed
US-4320061-A ANTISPASMODIC AGENTS KALI-CHEMIE PHARMA GMBH (DE) 1982-03-16 US disclosed
US-4279905-A GASTROINTESTINAL DISORDERS KALI-CHEMIE PHARMA GMBH (DE) 1981-07-21 US disclosed
EP-0025109-A2 1-Benzoxepin-5(2H)-one derivatives and their salts, and processes for their preparation Kali-Chemie Pharma GmbH (DE) 1981-03-18 EP 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 (5 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-20210188872-A1 TRICYCLIC HETEROCYCLES AS BET PROTEIN INHIBITORS BRD1, BRD3, BRD2 LMNA 3201/4885KDM4E 1447/4885SMN1; SMN2 4578/4885
US-20200339570-A1 BICYCLIC DERIVATIVES CCNY, BICRA, UQCRB LMNA 68/4885KDM4E 1613/4885SMN1; SMN2 3883/4885
US-11498926-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 LMNA 3201/4885KDM4E 1447/4885SMN1; SMN2 4578/4885
US-11304924-B2 Pharmaceutical compositions comprising nitroxyl donors TNNT2, TNNI3, NQO1 LMNA 3141/4885KDM4E 1476/4885SMN1; SMN2 793/4885
US-10919912-B2 Tricyclic heterocycles as BET protein inhibitors BRD1, BRD3, BRD2 LMNA 3201/4885KDM4E 1447/4885SMN1; SMN2 4578/4885

“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.