SCHEMBL7584536

SCHEMBL7584536

CCN1CCN(c2cc(CCCC#N)c(OC)c(-c3ccccc3)c2)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 6/20 0.43
CHRNA7 P36544 1/20 0.41
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
DRD2 P14416 4/20 0.38
DRD3 P35462 4/20 0.38
DRD4 P21917 3/20 0.38
TP53 P04637 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7587098 0.86 CHRNA7 (0.44) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7585071 0.86 CHRNA7 (0.44) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7583969 0.86 CHRNA7 (0.48) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7584437 0.85 CHRNA7 (0.47) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7586374 0.84 CHRNA7 (0.46) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7586804 0.84 CHRNA7 (0.50) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7582041 0.83 CHRNA7 (0.40) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7582941 0.82 CHRNA7 (0.49) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7585008 0.82 CHRNA7 (0.57) HTR7CHRNA7ADORA2AADORA1DRD2
SCHEMBL7584764 0.81 CHRNA7 (0.47) HTR7CHRNA7ADORA2AADORA1DRD2

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