SCHEMBL7982441

SCHEMBL7982441

O=C(O)c1ccc2c(oc3ccccc32)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.46
ALDH1A1 P00352 2/20 0.46
GLA P06280 2/20 0.46
GAA P10253 2/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TTR P02766 4/20 0.43
USP2 O75604 1/20 0.42
CSNK2A2 P19784 1/20 0.42
PTGS1 P23219 1/20 0.42
CSNK2B P67870 1/20 0.42
CSNK2A1 P68400 1/20 0.42
CSNK2A3 Q8NEV1 1/20 0.42
MAOB P27338 1/20 0.42
GPR35 Q9HC97 1/20 0.42
ALOX5 P09917 3/20 0.42
TBK1 Q9UHD2 1/20 0.42
HPGD P15428 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL10733241 0.84 KDM4E (0.40) KDM4EALDH1A1GLAGAALMNA
SCHEMBL11430498 0.83 PTGS2 (0.51) KDM4ELMNATSHRHSD17B10TTR
SCHEMBL17917510 0.82 TBK1 (0.48) KDM4EALDH1A1GLAGAALMNA
SCHEMBL30961906 0.82 TSHR (0.45) KDM4EALDH1A1GLAGAALMNA
SCHEMBL17917528 0.81 ALOX5 (0.48) KDM4EALDH1A1GLAGAALMNA
SCHEMBL783749 0.81 NR4A1 (0.50) KDM4EALDH1A1GLAUSP2CSNK2A2
SCHEMBL11553043 0.80 GPR35 (0.39) KDM4EALDH1A1GLAGAALMNA
SCHEMBL18854814 0.79 ALOX5 (0.55) KDM4ELMNAUSP2CSNK2A2PTGS1
SCHEMBL5017998 0.78 MAOA (0.55) KDM4EALDH1A1LMNAHSD17B10TTR
SCHEMBL30961909 0.78 KDM4E (0.42) KDM4EALDH1A1GLAGAALMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6300340-B1 USEFUL FOR THERAPY OF CANCER AND SOLID TUMORS ADIR ET COMPAGNIE (FR) 2001-10-09 US disclosed
US-6162822-A Bisimide compounds ADIR ET COMPAGNIE (FR) 2000-12-19 US disclosed
US-5854273-A Bisimide compounds ADIR ET COMPAGNIE (FR) 1998-12-29 US disclosed
US-4079052-A Diazopigments containing pyridine derivatives CIBA-GEIGY CORPORATION (US) 1978-03-14 US disclosed