SCHEMBL4392001

SCHEMBL4392001

Cc1cc(OCCCc2c[nH]cn2)ccc1CC=NO

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HTT P42858 1/20 0.31
GPR84 Q9NQS5 1/20 0.31
HRH3 Q9Y5N1 1/20 0.30
BCL2 P10415 1/20 0.30
MCL1 Q07820 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
SCHEMBL4385152 0.88 LTA4H (0.32)
SCHEMBL4386379 0.85 KCNH2 (0.35) KCNH2MEN1NPC1RAB9AKMT2A
SCHEMBL4384690 0.81 KCNH2 (0.34) KCNH2MEN1KMT2A
SCHEMBL4391999 0.77 KCNH2 (0.34) KCNH2MEN1NPC1RAB9AKMT2A
SCHEMBL4392008 0.77 KCNH2 (0.34) KCNH2MEN1NPC1RAB9AKMT2A
SCHEMBL4386375 0.74 HRH3 (0.42) HRH3
SCHEMBL4384666 0.74 LTA4H (0.33) KCNH2MEN1KMT2AHRH3
SCHEMBL4379690 0.73 KMT2A (0.52) KCNH2MEN1NPC1RAB9AKMT2A
SCHEMBL7991191 0.71 GAA (0.42) MEN1NPC1RAB9AKMT2AHRH3
SCHEMBL4389355 0.70 GPR84 (0.32) KCNH2NPC1RAB9AGPR84HRH3

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