SCHEMBL4390126

SCHEMBL4390126

CC(CCCCCc1c[nH]cn1)CNC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 2/20 0.36
HRH3 Q9Y5N1 2/20 0.36
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL4386824 0.87 HRH3 (0.36) HRH4HRH3
SCHEMBL4383625 0.82 HRH3 (0.39) HRH4HRH3
SCHEMBL4385039 0.79 TRPV1 (0.36) HRH3
SCHEMBL4382422 0.79 TRPV1 (0.36) HRH3
SCHEMBL7994725 0.76 L3MBTL1 (0.33) HRH3CYP2D6CYP2C19
SCHEMBL439550 0.74 HIF1A (0.35) HRH3
SCHEMBL8934768 0.74
SCHEMBL4381442 0.73 PLA2G2C (0.37) HRH4HRH3
SCHEMBL13734799 0.73 MAPT (0.33)
SCHEMBL4390122 0.72 HRH3 (0.63) HRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0760811-B1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 MODULATORS INST NAT SANTE RECH MED (FR) 2009-11-18 EP disclosed
US-6248765-B1 ANTIINFLAMMATORY AGENTS; HYPOTENSIVE AGENTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICAL (FR) 2001-06-19 US disclosed
WO-1996029315-A2 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H3 (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (FR) 1996-09-26 WO disclosed