SCHEMBL7320037

SCHEMBL7320037

O=c1nc(N2CCOCC2)oc2ccc(F)cc12

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 14/20 0.66
XRCC6 P12956 2/20 0.57
XRCC5 P13010 2/20 0.57
PIK3CB P42338 8/20 0.53
PIK3CD O00329 3/20 0.52
PIK3CA P42336 2/20 0.49
PIK3CG P48736 2/20 0.49

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
SCHEMBL7329165 0.85 PRKDC (0.67) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL7315961 0.84 PRKDC (0.66) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL7327543 0.80 PRKDC (0.72) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL14810333 0.80 FAAH (0.55) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL7321603 0.78 PRKDC (0.58) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL7325819 0.76 PRKDC (0.66) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL7317582 0.75 PRKDC (0.68) PRKDCXRCC6XRCC5PIK3CBPIK3CA
SCHEMBL7326777 0.73 PRKDC (0.67) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL21154541 0.72 FAAH (0.43) PRKDCXRCC6XRCC5PIK3CBPIK3CD
SCHEMBL21154491 0.71 ELANE (0.38) PRKDCXRCC6XRCC5PIK3CBPIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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