SCHEMBL7583647

SCHEMBL7583647

CCCC(F)c1cc(N2CCN(C)CC2)cc(-c2ccccc2C)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 3/20 0.38
CYP1A2 P05177 4/20 0.37
ALDH1A1 P00352 4/20 0.37
CYP3A4 P08684 3/20 0.37
CYP2D6 P10635 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CYP2C19 P33261 1/20 0.37
MAP4K1 Q92918 1/20 0.36
DRD2 P14416 3/20 0.36
DRD3 P35462 2/20 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
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
CSF1R P07333 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
SCHEMBL7585760 0.91 TACR1 (0.39) TACR1CYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL7584119 0.91 TACR1 (0.39) TACR1CYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL7591499 0.91 TACR1 (0.39) TACR1CYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL7585930 0.90 CHRNA7 (0.40) ALDH1A1KMT2ADRD2DRD3HTR1A
SCHEMBL7582940 0.90 CYP1A2 (0.40) CYP1A2ALDH1A1CYP3A4CYP2D6CYP2C19
SCHEMBL7590304 0.87 DRD2 (0.39) TACR1CYP1A2ALDH1A1CYP3A4CYP2D6
SCHEMBL7585740 0.84 DRD2 (0.44) DRD2DRD3HTR1AHTR2ALMNA
SCHEMBL7585162 0.81 CHRNA7 (0.42) ALDH1A1MEN1KMT2AHTR1ALMNA
SCHEMBL7583559 0.81 CYP1A2 (0.41) CYP1A2ALDH1A1CYP3A4CYP2D6CYP2C19
SCHEMBL7583597 0.80 CHRNA7 (0.41) ALDH1A1MEN1KMT2ADRD2DRD3

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