SCHEMBL4382423

SCHEMBL4382423

CCC(CCCc1c[nH]cn1)NC(=O)O

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
FAAH O00519 1/20 0.32
HCAR3 P49019 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
HRH3 Q9Y5N1 3/20 0.30
HRH4 Q9H3N8 1/20 0.30
LMNA P02545 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL4385040 0.91 PLA2G2C (0.36) TAS1R3TAS1R1HRH3HRH4POLB
SCHEMBL4381442 0.88 PLA2G2C (0.37) HRH3HRH4
SCHEMBL4383625 0.78 HRH3 (0.39) FAAHHRH3HRH4LMNA
SCHEMBL8798359 0.77 HRH3 (0.47) HRH3HRH4
SCHEMBL4389336 0.77
SCHEMBL2661142 0.77
SCHEMBL6682771 0.74 DPP7 (0.36) HRH3HRH4
SCHEMBL7994725 0.72 L3MBTL1 (0.33) HRH3POLB
SCHEMBL4382416 0.72 PRKCA (0.33)
SCHEMBL28866263 0.72 CA2 (0.40) TAS1R3TAS1R1LMNAPOLB

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