SCHEMBL4382420

SCHEMBL4382420

NC(=O)OCCCCCCc1c[nH]cn1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
NAAA Q02083 1/20 0.35
XDH P47989 3/20 0.34
GLA P06280 1/20 0.32
HRH3 Q9Y5N1 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
SCHEMBL480739 0.94 LMNA (0.46) LMNANAAAXDHGLAHRH3
SCHEMBL28715109 0.87 LMNA (0.38) LMNAGLA
SCHEMBL5157531 0.81 NAAA (0.35) LMNANAAAXDHHRH3
SCHEMBL7357227 0.79 CAPN1 (0.40) XDH
SCHEMBL4385037 0.79 HRH3 (0.36) LMNAGLAHRH3
SCHEMBL4386652 0.79 HRH3 (0.31) HRH3
SCHEMBL4389331 0.77
SCHEMBL28339640 0.77 NQO1 (0.39) LMNAGLA
SCHEMBL4381436 0.77 HRH3 (0.36) LMNAXDHHRH3
SCHEMBL28686683 0.77 LMNA (0.41) LMNANAAA

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