SCHEMBL4383472

SCHEMBL4383472

CC(=O)CCCc1ccc(OCCCc2c[nH]cn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
FFAR1 O14842 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
HRH3 Q9Y5N1 1/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 1/20 0.40
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL4383862 0.96 ALDH1A1 (0.46) ALDH1A1FFAR1MEN1KMT2ALMNA
SCHEMBL4378585 0.94 ALDH1A1 (0.53) ALDH1A1FFAR1MEN1KMT2ALMNA
SCHEMBL8934837 0.90 ALDH1A1 (0.45) ALDH1A1FFAR1MEN1KMT2ALMNA
SCHEMBL4378557 0.87 POLB (0.42) ALDH1A1FFAR1LMNAL3MBTL1HRH3
SCHEMBL4384959 0.85 FFAR1 (0.39) ALDH1A1FFAR1CYP4F2CYP4A11PPARG
SCHEMBL7991257 0.83 CYP3A4 (0.45) ALDH1A1MEN1KMT2ALMNAL3MBTL1
SCHEMBL4390063 0.82 FFAR1 (0.38) ALDH1A1FFAR1MEN1KMT2ALMNA
SCHEMBL4376187 0.82 L3MBTL1 (0.59) ALDH1A1LMNAL3MBTL1HRH3KDM4E
SCHEMBL4378233 0.81 FFAR1 (0.39) ALDH1A1FFAR1MEN1KMT2ALMNA
Oxalic Acid SCHEMBL7990912 0.81 MEN1 (0.47) ALDH1A1FFAR1MEN1KMT2ALMNA

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 4 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
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 EP 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