SCHEMBL7583440

SCHEMBL7583440

CCN1CCNCC1c1ccc(N)cc1.COc1ccc2cc1-2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.38
HTR2A P28223 3/20 0.38
HTR2B P41595 3/20 0.38
ACVR1 Q04771 4/20 0.38
TGFBR1 P36897 3/20 0.38
HTR7 P34969 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
FYN P06241 1/20 0.36
KDM1A O60341 1/20 0.35
DRD2 P14416 2/20 0.35
DRD3 P35462 2/20 0.35
RIPK2 O43353 1/20 0.35
NOD2 Q9HC29 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
SCHEMBL7588002 0.89 HTR2C (0.40) HTR2CHTR2AHTR2BHTR7DRD2
SCHEMBL7585550 0.88 KDM1A (0.47) HTR2CHTR2AHTR2BACVR1TGFBR1
SCHEMBL7586732 0.87 HTR2C (0.37) HTR2CHTR2AHTR2BHTR7DRD2
SCHEMBL7583723 0.87 NAAA (0.37) HTR2CHTR2AHTR2BACVR1HTR7
SCHEMBL7583638 0.87 DRD2 (0.44) CA1CA2DRD2DRD3
SCHEMBL7591745 0.86 HTR2C (0.39) HTR2CHTR2AHTR2BHTR7DRD2
SCHEMBL7589890 0.85 KMT2A (0.41) HTR2CHTR2AHTR2B
SCHEMBL7582903 0.83 DRD2 (0.43) HTR2CHTR2AHTR2BDRD2DRD3
SCHEMBL7587283 0.82 DRD2 (0.42) DRD2DRD3NOD2
SCHEMBL5240098 0.80 PDE4B (0.43) HTR2CHTR2AHTR2B

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