SCHEMBL7326225

SCHEMBL7326225

CC(=O)Oc1ccc2c(=O)c(C)c(N3CCOCC3)oc2c1C

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 13/20 0.69
GBA1 P04062 1/20 0.51
MAPT P10636 1/20 0.50
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KCNA3 P22001 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 1/20 0.41
PRKDC P78527 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
SCHEMBL7324297 0.81 P2RY12 (1.00) P2RY12MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL7317237 0.80 P2RY12 (0.60) P2RY12MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL9536497 0.80 PRKDC (0.64) P2RY12GBA1PRKDC
SCHEMBL7322397 0.78 P2RY12 (0.70) P2RY12PRKDC
SCHEMBL7318851 0.76 P2RY12 (0.64) P2RY12PRKDC
SCHEMBL7316704 0.76 P2RY12 (0.64) P2RY12PRKDC
SCHEMBL7321791 0.76 P2RY12 (0.71) P2RY12MEN1KMT2APOLBPRKDC
SCHEMBL7325246 0.75 P2RY12 (0.72) P2RY12PRKDC
SCHEMBL7329373 0.74 P2RY12 (0.54) P2RY12KDM4EALDH1A1KCNA3PRKDC
SCHEMBL16242694 0.73 P2RY12 (0.60) P2RY12KDM4EALDH1A1SMN1; SMN2MEN1

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-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