SCHEMBL7472084

SCHEMBL7472084

NC1[C]Cc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 5/20 0.46
ANPEP P15144 2/20 0.41
KDM1A O60341 4/20 0.39
HRH1 P35367 2/20 0.38
RET P07949 1/20 0.38
HTR2C P28335 1/20 0.38
SIGMAR1 Q99720 2/20 0.36
IDO1 P14902 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
SCHEMBL10649700 0.78 HTR2A (0.44) HTR2AANPEPKDM1ARETIDO1
SCHEMBL6763553 0.73 HTR2A (0.37) HTR2AANPEPHRH1RETHTR2C
SCHEMBL6613669 0.73 HTR2A (0.37) HTR2AANPEPHRH1RETHTR2C
SCHEMBL8776161 0.68 HTR2A (0.33) HTR2AHRH1RETHTR2C
SCHEMBL7469960 0.68 HTR2A (0.33) HTR2AHRH1IDO1
SCHEMBL7476953 0.66 ANPEP (0.32) HTR2AANPEPHTR2C
SCHEMBL2158302 0.66 TSHR (0.45) SIGMAR1
SCHEMBL545454 0.64 MEN1 (0.53) HTR2AKDM1AHRH1RETHTR2C
SCHEMBL29490140 0.64 MEN1 (0.53) HTR2AKDM1AHRH1RETHTR2C
SCHEMBL8247822 0.64 HTR2A (1.00) HTR2AANPEPKDM1AHRH1HTR2C

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0650476-B1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMA CO LTD (JP) 2002-06-26 EP disclosed
US-6136826-A AMINOPIPERIDINE COMPOUNDS SUBSTITUTED WITH ALKANOYL OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
CN-1052224-C Peripheral Vasodilating agent containing N-acylated 4-amino piperidine derivatives as active ingredients OTSUKA PHARMA CO LTD (JP) 2000-05-10 CN disclosed
US-5760058-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1998-06-02 US disclosed
US-5656642-A Peripheral vasodilating agent containing piperidine derivative as active ingredient OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-08-12 US disclosed
EP-0650476-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-05-03 EP disclosed
WO-1994022826-A1 PERIPHERAL VASODILATING AGENT CONTAINING N-ACYLATED 4-AMINO PIPERIDINE DERIVATIVES AS ACTIVE INGREDIENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-10-13 WO disclosed