SCHEMBL7585552

SCHEMBL7585552

CCCCC(F)c1cc(N2CCN(CC)CC2)cc(-c2ccccc2)c1OC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.41
DPP4 P27487 1/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
HTR7 P34969 1/20 0.39
DRD2 P14416 4/20 0.37
DRD4 P21917 1/20 0.37
HTR1A P08908 1/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35
TGFBR1 P36897 1/20 0.35
ACVR1 Q04771 1/20 0.35
SYK P43405 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
DRD3 P35462 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL7583536 0.94 CHRNA7 (0.43) CHRNA7DPP4ADORA2AADORA1HTR7
SCHEMBL7585102 0.89 CHRNA7 (0.45) CHRNA7ADORA2AADORA1HTR7DRD2
SCHEMBL7581507 0.87 CHRNA7 (0.39) CHRNA7ADORA2AADORA1HTR7DRD2
SCHEMBL7583442 0.82 ADORA2A (0.38) CHRNA7ADORA2AADORA1HTR7DRD2
SCHEMBL7585008 0.82 CHRNA7 (0.57) CHRNA7ADORA2AADORA1HTR7DRD2
SCHEMBL7590798 0.82 CHRNA7 (0.40) CHRNA7DPP4ADORA2AADORA1HTR7
SCHEMBL7585918 0.82 ADORA2A (0.38) CHRNA7ADORA2AADORA1HTR7DRD2
SCHEMBL7583814 0.81 CHRNA7 (0.45) CHRNA7ADORA2AADORA1HTR7HTR1A
SCHEMBL7583969 0.79 CHRNA7 (0.48) CHRNA7ADORA2AADORA1HTR7DRD2
SCHEMBL7582087 0.79 CHRNA7 (0.50) CHRNA7DPP4ADORA2AADORA1HTR7

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-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP claimed
EP-0675118-A2 Biphenylderivatives, process for their preparation and their use as medicaments Eisai Co., Ltd. (JP) 1995-10-04 EP claimed
EP-0675118-B1 Biphenylderivatives, process for their preparation and their use as medicaments EISAI CO LTD (JP) 2002-10-09 EP disclosed
US-6281214-B1 USEFUL FOR TREATING AND AMELIORATING MENTAL DISORDERS EISAI CO., LTD (JP) 2001-08-28 US disclosed
EP-0675118-A2 Biphenylderivatives, process for their preparation and their use as medicaments Eisai Co., Ltd. (JP) 1995-10-04 EP disclosed