SCHEMBL7306382

SCHEMBL7306382

CCON=Cc1ccc(C(=O)N(C)c2ccc3c(c2)CC(CC(=O)OCC)CC3)cc1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 4/20 0.36
ITGA2B P08514 4/20 0.36
KDM4E B2RXH2 5/20 0.34
MEN1 O00255 5/20 0.34
MAPT P10636 5/20 0.34
KMT2A Q03164 5/20 0.34
ALDH1A1 P00352 4/20 0.34
POLB P06746 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
MCHR1 Q99705 7/20 0.33
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
HPGD P15428 2/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
DRD2 P14416 1/20 0.31
DRD3 P35462 1/20 0.31

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
SCHEMBL7301234 0.95 ITGB3 (0.36) ITGB3ITGA2BKDM4EMEN1MAPT
SCHEMBL7311917 0.85 MAPT (0.43) ITGB3ITGA2BKDM4EMAPTKMT2A
SCHEMBL7306377 0.84 ITGB3 (0.40) ITGB3ITGA2BMCHR1DRD2DRD3
SCHEMBL7318519 0.84 ITGB3 (0.33) ITGB3ITGA2BKDM4EMEN1MAPT
SCHEMBL7307574 0.84 ALDH1A1 (0.35) ITGB3ITGA2BMEN1MAPTKMT2A
SCHEMBL7311321 0.84 ITGB3 (0.50) ITGB3ITGA2B
SCHEMBL7298306 0.83 ITGB3 (0.54) ITGB3ITGA2BMAPTALDH1A1SMN1; SMN2
SCHEMBL7308658 0.83 ITGB3 (0.47) ITGB3ITGA2BMCHR1
SCHEMBL7298312 0.83 ITGB3 (0.54) ITGB3ITGA2BMAPTALDH1A1SMN1; SMN2
SCHEMBL7308655 0.83 ITGB3 (0.47) ITGB3ITGA2BMCHR1

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
EP-0709370-B1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI CHEMICALS INC (JP) 1999-01-13 EP disclosed
US-5629321-A FIBRINOGEN ANTAGONIST MITSUI TOATSU CHEMICALS, INC. (JP) 1997-05-13 US disclosed
EP-0709370-A1 Bicyclic compounds useful as platelet aggregation inhibitors MITSUI TOATSU CHEMICALS, Inc. (JP) 1996-05-01 EP disclosed