SCHEMBL7312192

SCHEMBL7312192

CCCCO/N=C/c1ccc(C(=O)Nc2ccc3c(c2)CC(CC(=O)OCCCC)CC3)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 7/20 0.52
ITGA2B P08514 7/20 0.52
MCHR1 Q99705 11/20 0.44
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL7312196 1.00 ITGB3 (0.52) ITGB3ITGA2BMCHR1KDM4EMEN1
SCHEMBL7307220 0.95 ITGB3 (0.46) ITGB3ITGA2BMCHR1MAPTSMN1; SMN2
SCHEMBL7307214 0.95 ITGB3 (0.46) ITGB3ITGA2BMCHR1MAPTSMN1; SMN2
SCHEMBL7308968 0.93 ITGB3 (0.53) ITGB3ITGA2BMCHR1
SCHEMBL7308974 0.93 ITGB3 (0.53) ITGB3ITGA2BMCHR1
SCHEMBL7298306 0.89 ITGB3 (0.54) ITGB3ITGA2BMCHR1MAPTRAB9A
SCHEMBL7298312 0.89 ITGB3 (0.54) ITGB3ITGA2BMCHR1MAPTRAB9A
SCHEMBL7438298 0.87 ITGB3 (0.49) ITGB3ITGA2BMCHR1MAPTRAB9A
SCHEMBL7393874 0.87 ITGB3 (0.49) ITGB3ITGA2BMCHR1MAPTRAB9A
SCHEMBL7393876 0.87 ITGB3 (0.49) ITGB3ITGA2BMCHR1MAPTRAB9A

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