SCHEMBL6590035

SCHEMBL6590035

COC(=O)c1scc(CN2CCOCC2)c1Cl

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.54
HCRTR2 O43614 1/20 0.54
F10 P00742 5/20 0.52
F2 P00734 4/20 0.52
SMN1; SMN2 Q16637 3/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
HIF1A Q16665 1/20 0.43
EPAS1 Q99814 1/20 0.43
CYP2A13 Q16696 2/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 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
SCHEMBL6592233 0.87 F10 (0.54) HCRTR1HCRTR2F10F2KDM4E
SCHEMBL6595675 0.87 F10 (0.52) HCRTR1HCRTR2F10F2ALDH1A1
SCHEMBL27457202 0.85 HCRTR1 (0.40) HCRTR1HCRTR2F10F2SMN1; SMN2
SCHEMBL6600222 0.83 F10 (0.53) HCRTR1HCRTR2F10F2KDM4E
SCHEMBL27470745 0.82 F10 (0.52) HCRTR1HCRTR2F10F2KDM4E
SCHEMBL6594051 0.81 F10 (0.51) HCRTR1HCRTR2F10F2SMN1; SMN2
SCHEMBL3829188 0.80 KMT2A (0.52) HCRTR1HCRTR2SMN1; SMN2MAPK1ALDH1A1
SCHEMBL6587977 0.75 KMT2A (0.39) F10KDM4ETSHRKMT2AMAPT
SCHEMBL6591889 0.75 KMT2A (0.39) F10MAPK1KDM4ETSHRKMT2A
SCHEMBL30696969 0.74 CYP2A13 (0.46) HCRTR1HCRTR2F10F2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1143855-C I (ortho)-anthranilamide derivatives as anti-coagulants ���ֹɷݹ�˾ 2004-03-31 CN disclosed
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
CN-1282329-A I (ortho)-anthranilamide derivatives as anti-coagulants SCHERING AG (DE) 2001-01-31 CN 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