SCHEMBL7587432

SCHEMBL7587432

CCc1ccccc1-c1cc(N2CCN(CCO)CC2)cc(C(F)CC)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
DRD3 P35462 5/20 0.37
DRD2 P14416 5/20 0.37
DRD4 P21917 3/20 0.37
HTR1A P08908 2/20 0.37
OPRM1 P35372 2/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HRH4 Q9H3N8 1/20 0.36
BCL2 P10415 1/20 0.34
BAK1 Q16611 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
BCL2A1 Q16548 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
SCHEMBL7583679 0.90 DRD2 (0.44) MAPTNPSR1DRD3DRD2HTR1A
SCHEMBL7582663 0.90 CHRNA7 (0.41) MAPTDRD3DRD2DRD4HTR1A
SCHEMBL7582205 0.89 DRD2 (0.38) MAPTNPSR1DRD3DRD2HTR1A
SCHEMBL7584122 0.86 MAPT (0.38) MAPTNPSR1DRD3DRD2HRH4
SCHEMBL7955784 0.86 MAPT (0.38) MAPTNPSR1DRD3DRD2HRH4
SCHEMBL7583655 0.86 CHRNA7 (0.39) DRD3DRD2DRD4BCL2BAK1
SCHEMBL7589752 0.85 DRD2 (0.36) MAPTNPSR1DRD3DRD2DRD4
Hydrochloric Acid SCHEMBL7585021 0.85 DRD2 (0.35) MAPTNPSR1DRD3DRD2DRD4
Hydrochloric Acid SCHEMBL7584884 0.85 DRD2 (0.35) MAPTNPSR1DRD3DRD2DRD4
SCHEMBL7583011 0.85 HTR2C (0.38) NPSR1DRD3DRD2DRD4HTR1A

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