SCHEMBL7584443

SCHEMBL7584443

CCN1CCNCC1c1ccc(O)cc1.c1cc2cc-2c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.38
KAT7 O95251 1/20 0.37
MEN1 O00255 1/20 0.37
ESR1 P03372 1/20 0.37
KMT2A Q03164 1/20 0.37
PRKCZ Q05513 2/20 0.36
DRD1 P21728 1/20 0.35
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
TAAR1 Q96RJ0 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
SCHEMBL7582143 0.86 CHRM3 (0.41) HTR2AHTR2CHTR2B
SCHEMBL7583073 0.83 HTR2A (0.40) TDP1MEN1KMT2AHTR2AHTR2C
SCHEMBL470870 0.79 P2RX7 (0.43) TDP1HTR2AHTR2CHTR2BTAAR1
SCHEMBL410563 0.79 P2RX7 (0.43) TDP1HTR2AHTR2CHTR2BTAAR1
SCHEMBL18741430 0.78 ADRB1 (0.40) MEN1KMT2AHTR2AHTR2CHTR2B
SCHEMBL30853839 0.76 HTR3A (0.44) HTR2AHTR2CHTR2B
SCHEMBL22382688 0.76 RIPK1 (0.43) TDP1HTR2AHTR2CHTR2B
SCHEMBL8458372 0.74 AKT1 (0.39) L3MBTL1HTR2AHTR2CHTR2B
SCHEMBL7584116 0.72 ADRA2C (0.38) HTR2CHTR2B
Hydrochloric Acid SCHEMBL9226443 0.72 ADRA2C (0.37) HTR2CHTR2B

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