SCHEMBL7423741

SCHEMBL7423741

CCOC(=O)c1cc2ccccc2n1CC(=O)Cl

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.73
MEN1 O00255 1/20 0.73
NOD2 Q9HC29 6/20 0.69
NOD1 Q9Y239 6/20 0.69
KDM4E B2RXH2 2/20 0.62
CRHBP P24387 1/20 0.62
CRHR2 Q13324 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
F10 P00742 2/20 0.61
MTNR1A P48039 1/20 0.48
MTNR1B P49286 1/20 0.48
POLB P06746 2/20 0.47
TSHR P16473 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
ATM Q13315 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
HSD17B10 Q99714 1/20 0.47
SRC P12931 1/20 0.46
CCR2 P41597 1/20 0.46

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
SCHEMBL7425465 0.88 MEN1 (0.79) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL18202169 0.88 MEN1 (0.74) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL16201674 0.88 MEN1 (0.74) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL3259707 0.86 NOD2 (0.71) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL10629278 0.85 KMT2A (0.71) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL28669136 0.85 NOD2 (0.70) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL14994342 0.84 MEN1 (0.70) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL4798323 0.84 NOD2 (0.85) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL23052993 0.83 NOD2 (0.64) KMT2AMEN1NOD2NOD1KDM4E
SCHEMBL6752352 0.82 KDM4E (0.71) KMT2AMEN1NOD2NOD1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6337344-B1 ANTICOAGULANTS AND ENZYME INHIBITORS FOR CARDIOVASCULAR DISORDERS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-01-08 US disclosed
EP-1042287-A1 INDOLE DERIVATIVES AS INHIBITORS OF FACTOR XA Aventis Pharma Deutschland GmbH (DE) 2000-10-11 EP disclosed
WO-1999033800-A1 INDOLE DERIVATIVES AS INHIBITORS OR FACTOR XA AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 1999-07-08 WO disclosed