SCHEMBL7582940

SCHEMBL7582940

CCCC(F)c1cc(N2CCN(C)CC2)cc(-c2ccccc2Cl)c1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 2/20 0.40
CYP2D6 P10635 2/20 0.40
HSD17B10 Q99714 2/20 0.40
CYP2C19 P33261 2/20 0.40
ALOX15 P16050 1/20 0.40
DRD2 P14416 6/20 0.39
DRD3 P35462 5/20 0.39
HRH4 Q9H3N8 1/20 0.37
HTR2A P28223 4/20 0.36
TDP2 O95551 1/20 0.36
NSD2 O96028 1/20 0.36
PLA2G1B P04054 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
HTR1A P08908 1/20 0.36
DRD4 P21917 1/20 0.36
HTR2C P28335 1/20 0.36
PDK2 Q15119 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7583559 0.91 CYP1A2 (0.41) CYP1A2CYP3A4CYP2D6HSD17B10CYP2C19
SCHEMBL7583597 0.90 CHRNA7 (0.41) DRD2DRD3HTR2AALDH1A1LMNA
SCHEMBL7583647 0.90 TACR1 (0.38) CYP1A2CYP3A4CYP2D6HSD17B10CYP2C19
SCHEMBL7591499 0.81 TACR1 (0.39) CYP1A2CYP3A4CYP2D6HSD17B10CYP2C19
SCHEMBL7585656 0.81 CHRNA7 (0.43) DRD2DRD3ALDH1A1LMNAHTR7
SCHEMBL7584119 0.81 TACR1 (0.39) CYP1A2CYP3A4CYP2D6HSD17B10CYP2C19
SCHEMBL7585760 0.81 TACR1 (0.39) CYP1A2CYP3A4CYP2D6HSD17B10CYP2C19
SCHEMBL7585930 0.81 CHRNA7 (0.40) DRD2DRD3HTR2AHTR1AALDH1A1
SCHEMBL7583679 0.80 DRD2 (0.44) DRD2DRD3HRH4HTR1AALDH1A1
SCHEMBL7583453 0.79 DRD2 (0.38) CYP1A2CYP2C19ALOX15DRD2DRD3

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