SCHEMBL7310310

SCHEMBL7310310

Oc1cccc(C=CCN2CCC(=C3c4ccccc4C=Cc4ccccc43)CC2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 3/20 0.51
TSHR P16473 3/20 0.45
ALDH1A1 P00352 3/20 0.45
ADRA2A P08913 2/20 0.45
ADRA2C P18825 2/20 0.45
SLC6A4 P31645 2/20 0.45
ABCB11 O95342 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45
HTR1A P08908 1/20 0.45
CHRM5 P08912 1/20 0.45
CYP2D6 P10635 1/20 0.45
CHRM1 P11229 1/20 0.45
DRD2 P14416 1/20 0.45
ADRA2B P18089 1/20 0.45
CHRM3 P20309 1/20 0.45
DRD1 P21728 1/20 0.45
TBXA2R P21731 1/20 0.45

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
SCHEMBL7310304 1.00 SETD7 (0.51) SETD7TSHRALDH1A1ADRA2AADRA2C
Hydrochloric Acid SCHEMBL7218875 0.99 SETD7 (0.50) SETD7TSHRALDH1A1ADRA2AADRA2C
Hydrochloric Acid SCHEMBL7218872 0.99 SETD7 (0.50) SETD7TSHRALDH1A1ADRA2AADRA2C
SCHEMBL7296028 0.87 SETD7 (0.54) SETD7TSHRALDH1A1ADRA2AADRA2C
SCHEMBL7296032 0.87 SETD7 (0.54) SETD7TSHRALDH1A1ADRA2AADRA2C
SCHEMBL7306252 0.87 SETD7 (0.59) SETD7TSHRALDH1A1ADRA2AADRA2C
SCHEMBL7306260 0.87 SETD7 (0.59) SETD7TSHRALDH1A1ADRA2AADRA2C
SCHEMBL7309696 0.86 SETD7 (0.51) SETD7TSHRALDH1A1ADRA2AADRA2C
SCHEMBL7309699 0.86 SETD7 (0.51) SETD7TSHRALDH1A1ADRA2AADRA2C
Hydrochloric Acid SCHEMBL7217697 0.86 SETD7 (0.53) SETD7TSHRALDH1A1ADRA2AADRA2C

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-0479601-B1 Piperidine derivatives and their use as antiarrhythmic agents AJINOMOTO KK (JP) 1999-12-15 EP claimed
US-5229400-A Cardiovascular disorders AJINOMOTO CO., INC. (JP) 1993-07-20 US claimed
EP-0479601-B1 Piperidine derivatives and their use as antiarrhythmic agents AJINOMOTO KK (JP) 1999-12-15 EP disclosed
US-5250681-A Piperidine derivatives and hypotensives containing the same AJINOMOTO CO., INC. (JP) 1993-10-05 US disclosed
US-5229400-A Cardiovascular disorders AJINOMOTO CO., INC. (JP) 1993-07-20 US disclosed
EP-0479601-A2 Piperidine derivatives and their use as antiarrhythmic agents Ajinomoto Co., Inc. (JP) 1992-04-08 EP disclosed