SCHEMBL6590835

SCHEMBL6590835

O=c1[nH]c(=O)c2ccc(F)cc2o1

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.45
NQO1 P15559 1/20 0.45
DAO P14920 1/20 0.43
KDM4E B2RXH2 1/20 0.41
CDC25A P30304 1/20 0.41
CDC25C P30307 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
CYP11B1 P15538 1/20 0.40
CYP11B2 P19099 1/20 0.40
PARP1 P09874 7/20 0.40
PARP3 Q9Y6F1 1/20 0.38

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
SCHEMBL6590435 0.85 GABRP (0.47) NQO1DAOKDM4ECDC25ACDC25C
SCHEMBL4836194 0.82 MAOB (0.46) MAOBNQO1DAOCDC25ACDC25C
SCHEMBL1071182 0.78 DAO (0.58) DAOCDC25ACDC25CLMNAPARP1
SCHEMBL2289312 0.78 NOS1 (0.62) MAOBKDM4ECDC25ACDC25CALDH1A1
SCHEMBL8777948 0.78 KDM4E (0.50) KDM4EALDH1A1LMNAMAPTPARP1
SCHEMBL25394296 0.78 KDM4E (0.55) MAOBNQO1KDM4EALDH1A1LMNA
SCHEMBL1500233 0.78 METAP2 (0.43) LMNACYP11B1CYP11B2
SCHEMBL2149352 0.77 NOS1 (0.61) KDM4EALDH1A1LMNAPOLB
SCHEMBL6590061 0.77 KMO (0.37) LMNA
SCHEMBL2284104 0.74 KDM4E (0.57) MAOBNQO1KDM4EALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1040108-B1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AG (DE) 2004-02-25 EP disclosed
US-6498185-B1 ENZYME FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. 2002-12-24 US disclosed
US-6380221-B1 FOR THERAPY OF DISEASE-STATES CHARACTERIZED BY THROMBOTIC ACTIVITY BERLEX LABORATORIES, INC. 2002-04-30 US disclosed
US-6140351-A FOR TREATING THROMBOSIS BERLEX LABORATORIES, INC. (US) 2000-10-31 US disclosed
EP-1040108-A1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AKTIENGESELLSCHAFT (DE) 2000-10-04 EP disclosed
WO-1999032477-A1 ORTHO-ANTHRANILAMIDE DERIVATIVES AS ANTI-COAGULANTS SCHERING AKTIENGESELLSCHAFT (DE) 1999-07-01 WO disclosed