SCHEMBL7299134

SCHEMBL7299134

COc1ccc(C(=O)CN2CCC(=C3c4ccccc4C=Cc4ccccc43)CC2)cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 3/20 0.51
ALDH1A1 P00352 6/20 0.51
MAPT P10636 5/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2D6 P10635 2/20 0.51
CYP2C19 P33261 2/20 0.51
CYP3A4 P08684 1/20 0.51
POLB P06746 1/20 0.51
ALOX15 P16050 1/20 0.48
PDE4B Q07343 1/20 0.46
ABCB1 P08183 1/20 0.46
HTT P42858 2/20 0.45
ABCB11 O95342 1/20 0.45
TP53 P04637 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
ADRA2A P08913 1/20 0.45
CHRM1 P11229 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
Hydrochloric Acid SCHEMBL7212583 0.99 ALDH1A1 (0.50) SETD7ALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL9035896 0.90 SIGMAR1 (0.54) SETD7ALDH1A1MAPTCYP1A2CYP2D6
Hydrochloric Acid SCHEMBL7212711 0.89 SIGMAR1 (0.53) SETD7ALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL7299683 0.88 SETD7 (0.53) SETD7ALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL9034437 0.87 SETD7 (0.54) SETD7ALDH1A1CYP1A2CYP2D6CYP2C19
Hydrochloric Acid SCHEMBL9034533 0.87 SETD7 (0.52) SETD7ALDH1A1MAPTCYP1A2CYP2D6
Hydrochloric Acid SCHEMBL7212361 0.86 SETD7 (0.53) SETD7ALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL9036801 0.84 MAPK1 (0.54) SETD7ALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL7212545 0.82 SETD7 (0.46) SETD7ALDH1A1MAPTCYP1A2CYP2D6
SCHEMBL9035696 0.81 SETD7 (0.59) SETD7ALDH1A1MAPTCYP1A2CYP2D6

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-0479601-B1 Piperidine derivatives and their use as antiarrhythmic agents AJINOMOTO KK (JP) 1999-12-15 EP claimed
EP-0371805-B1 Piperidine derivatives and hypotensives containing the same AJINOMOTO KK (JP) 1996-06-26 EP claimed
US-5229400-A Cardiovascular disorders AJINOMOTO CO., INC. (JP) 1993-07-20 US claimed
EP-0371805-A2 Piperidine derivatives and hypotensives containing the same AJINOMOTO CO., INC. (JP) 1990-06-06 EP claimed
EP-0479601-B1 Piperidine derivatives and their use as antiarrhythmic agents AJINOMOTO KK (JP) 1999-12-15 EP 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