SCHEMBL7306822

SCHEMBL7306822

OC1=C(O)c2ccccc2C(=C2CCN(CCCCC3CCCCC3)CC2)c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 2/20 0.45
S1PR5 Q9H228 1/20 0.40
HRH1 P35367 1/20 0.40
SIGMAR1 Q99720 3/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
KDM1A O60341 1/20 0.37
MAOB P27338 1/20 0.37
CHRM3 P20309 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL7309692 0.86 SETD7 (0.51) SETD7S1PR5HRH1SIGMAR1CHRM3
SCHEMBL7300338 0.85 SETD7 (0.64) SETD7S1PR5HRH1SIGMAR1ATM
SCHEMBL7300258 0.84 SETD7 (0.52) SETD7S1PR5HRH1SIGMAR1ATM
SCHEMBL9035322 0.84 SETD7 (0.66) SETD7S1PR5HRH1SIGMAR1ATM
SCHEMBL7307090 0.84 SETD7 (0.52) SETD7S1PR5HRH1SIGMAR1ATM
SCHEMBL7309778 0.84 SETD7 (0.66) SETD7S1PR5HRH1SIGMAR1ATM
Hydrochloric Acid SCHEMBL7213749 0.84 SETD7 (0.62) SETD7S1PR5HRH1SIGMAR1ATM
SCHEMBL9034738 0.84 SETD7 (0.66) SETD7S1PR5HRH1SIGMAR1ATM
SCHEMBL9034364 0.84 SETD7 (0.66) SETD7S1PR5HRH1SIGMAR1ATM
Hydrochloric Acid SCHEMBL7217685 0.83 SETD7 (0.65) SETD7S1PR5HRH1SIGMAR1ATM

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 5 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-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