SCHEMBL10360412

SCHEMBL10360412

Nc1ccc(OCCN2CCc3ccc(N)cc3CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.60
PTGS1 P23219 1/20 0.60
PTGS2 P35354 1/20 0.60
HRH3 Q9Y5N1 12/20 0.54
ABCB1 P08183 1/20 0.48
HRH1 P35367 3/20 0.47
PSMB1 P20618 1/20 0.44
PSMB5 P28074 1/20 0.44
PSMB2 P49721 1/20 0.44

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
SCHEMBL10360467 0.86 HRH3 (0.50) LTA4HPTGS1PTGS2HRH3HRH1
SCHEMBL519769 0.82 ALK (0.44) LTA4HPTGS1PTGS2HRH3ABCB1
SCHEMBL76551 0.80 LTA4H (0.69) LTA4HPTGS1PTGS2HRH3PSMB1
SCHEMBL56495 0.79 LTA4H (0.90) LTA4HPTGS1PTGS2HRH3PSMB1
SCHEMBL8790607 0.79 ABCB1 (0.78) ABCB1
SCHEMBL23724061 0.78 LTA4H (0.87) LTA4HPTGS1PTGS2HRH3PSMB1
Hydrochloric Acid SCHEMBL15254264 0.78 LTA4H (0.87) LTA4HPTGS1PTGS2HRH3PSMB1
SCHEMBL3937460 0.78 LTA4H (0.87) LTA4HPTGS1PTGS2HRH3PSMB1
SCHEMBL10361498 0.77 SIGMAR1 (0.53) HRH3ABCB1
SCHEMBL1957333 0.76 PNMT (0.45) HRH3

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-0284384-B1 ANTI-ARRHYTHMIC AGENTS Pfizer Limited (GB) 1990-11-28 EP claimed
EP-0284384-A1 Anti-arrhythmic agents Pfizer Limited (GB) 1988-09-28 EP claimed
EP-0284384-B1 ANTI-ARRHYTHMIC AGENTS Pfizer Limited (GB) 1990-11-28 EP disclosed
US-4891372-A Antiarrhythmic agents, compositions and method of use thereas PFIZER INC. (US) 1990-01-02 US disclosed
EP-0284384-A1 Anti-arrhythmic agents Pfizer Limited (GB) 1988-09-28 EP disclosed