SCHEMBL7587283

SCHEMBL7587283

CCNS(=O)(=O)c1ccc(C2CNCCN2CC)cc1.COc1ccc2cc1-2

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.42
DRD3 P35462 5/20 0.42
ALDH1A1 P00352 1/20 0.41
ROCK2 O75116 1/20 0.38
HTR6 P50406 5/20 0.37
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
GLA P06280 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NOD2 Q9HC29 1/20 0.36
MAPT P10636 1/20 0.36
BRD4 O60885 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
SCHEMBL7583638 0.88 DRD2 (0.44) DRD2DRD3MAPT
SCHEMBL7582903 0.86 DRD2 (0.43) DRD2DRD3ALDH1A1MAPT
SCHEMBL7589890 0.83 KMT2A (0.41) ALDH1A1SMN1; SMN2
SCHEMBL7583440 0.82 HTR2C (0.38) DRD2DRD3NOD2
SCHEMBL7588002 0.82 HTR2C (0.40) DRD2DRD3
SCHEMBL7591745 0.82 HTR2C (0.39) DRD2DRD3ALDH1A1
SCHEMBL7585550 0.81 KDM1A (0.47) HRH3
SCHEMBL7583723 0.81 NAAA (0.37) DRD2DRD3
SCHEMBL7586732 0.81 HTR2C (0.37) DRD2DRD3ALDH1A1HTR6
SCHEMBL7586087 0.76 DRD2 (0.39) DRD2DRD3ALDH1A1

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 6 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
US-5849912-A Biphenyl derivatives EISAI CO., LTD. (JP) 1998-12-15 US disclosed
EP-0675118-A2 Biphenylderivatives, process for their preparation and their use as medicaments Eisai Co., Ltd. (JP) 1995-10-04 EP disclosed