SCHEMBL7320166

SCHEMBL7320166

Cc1c(OCc2cccnc2)ccc2c(=O)cc(N3CCCCC3)oc12

nearest known ligand 0.84

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 16/20 0.84
PDE3B Q13370 1/20 0.61
PDE3A Q14432 1/20 0.61
PRKDC P78527 3/20 0.60
PIK3CD O00329 1/20 0.60
PIK3CA P42336 1/20 0.60
PIK3CB P42338 1/20 0.60
PIK3CG P48736 1/20 0.60

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
SCHEMBL7324324 0.92 P2RY12 (1.00) P2RY12PRKDCPIK3CDPIK3CAPIK3CB
SCHEMBL7322128 0.88 P2RY12 (0.83) P2RY12PRKDC
SCHEMBL7330070 0.87 P2RY12 (0.84) P2RY12PRKDC
SCHEMBL7351469 0.81 P2RY12 (0.80) P2RY12PRKDCPIK3CDPIK3CAPIK3CB
SCHEMBL7360857 0.80 P2RY12 (0.80) P2RY12PRKDCPIK3CDPIK3CAPIK3CB
SCHEMBL7361296 0.80 P2RY12 (0.81) P2RY12PRKDC
SCHEMBL14391859 0.80 PRKDC (0.64) P2RY12PRKDC
SCHEMBL7326044 0.79 P2RY12 (0.81) P2RY12PRKDC
SCHEMBL7320050 0.79 P2RY12 (0.85) P2RY12PRKDC
SCHEMBL7326740 0.79 P2RY12 (1.00) P2RY12PRKDC

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
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 US claimed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP claimed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO claimed
US-5703075-A Antiatherosclerotic and antithrombotic 1-benzopyran-4-ones and 2-amino-1,3-benzoxazine-4-ones PHARMACIA & UPJOHN COMPANY (US) 1997-12-30 US disclosed
EP-0459983-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES PHARMACIA & UPJOHN COMPANY (US) 1991-12-11 EP disclosed
WO-1990006921-A1 ANTIATHEROSCLEROTIC AND ANTITHROMBOTIC 1-BENZOPYRAN-4-ONES AND 2-AMINO-1,3-BENZOXAZINE-4-ONES THE UPJOHN COMPANY (US) 1990-06-28 WO disclosed