SCHEMBL7735654

SCHEMBL7735654

OCC#Cc1cc(Cl)cc2nc(Cc3cccc(Cl)c3)oc12

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.42
RAB9A P51151 6/20 0.42
PKM P14618 2/20 0.40
KMT2A Q03164 3/20 0.38
RXFP1 Q9HBX9 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
PTK2 Q05397 1/20 0.37
MEN1 O00255 1/20 0.36

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
SCHEMBL7737473 0.91 MEN1 (0.39) NPC1RAB9AKMT2ALMNATP53
SCHEMBL7737540 0.87 MAPT (0.44) NPC1KMT2ALMNATP53MAPT
SCHEMBL7737446 0.86 PGK1 (0.35) KMT2AMEN1
SCHEMBL7733881 0.83 NLRP3 (0.36) LMNAMAPTPTK2
SCHEMBL7734760 0.82 MAPT (0.42) NPC1RAB9AKMT2ALMNAMAPT
SCHEMBL7724886 0.82 SMN1; SMN2 (0.35) RAB9AKMT2ALMNATP53MAPT
SCHEMBL7724872 0.81 GAA (0.36) NPC1RAB9AKMT2AMAPTMEN1
SCHEMBL7734791 0.80 RAB9A (0.39) NPC1RAB9APKMKMT2A
SCHEMBL7679979 0.79 DHFR (0.34) NPC1RAB9AKMT2ALMNATP53
SCHEMBL7735271 0.79 MAOB (0.41) NPC1RAB9ALMNATP53MAPT

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
US-6372770-B1 TREATING A MAMMAL SUFFERING FROM A DISEASE STATE SELECTED FROM THE GROUP CONSISTING OF ASTHMA, ALLERGIES, INFLAMMATION, DEPRESSION, DEMENTIA, ATOPIC DISEASES, RHINITIS AND DISEASE STATES ASSOCIATED WITH ABNORMALLY HIGH PHYSIOLOGICAL LEVELS OF EURO-CELTIQUE, S.A. 2002-04-16 US disclosed
EP-0785927-A4 NOVEL BENZOXAZOLES EURO CELTIQUE SA (LU) 1997-12-29 EP disclosed
EP-0785927-A1 NOVEL BENZOXAZOLES Euroceltique S.A. (LU) 1997-07-30 EP disclosed
WO-1996011917-A1 NOVEL BENZOXAZOLES EURO-CELTIQUE, S.A. (LU) 1996-04-25 WO disclosed