SCHEMBL19612232

SCHEMBL19612232

Clc1cc(OCCc2ccccc2)ccc1OCCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
MAOA P21397 4/20 0.51
MAOB P27338 4/20 0.51
PPARG P37231 5/20 0.50
PPARA Q07869 2/20 0.50
HPGD P15428 2/20 0.50
GPR84 Q9NQS5 1/20 0.50
PPARD Q03181 1/20 0.49
FFAR1 O14842 1/20 0.47
LTB4R Q15722 2/20 0.47
LTB4R2 Q9NPC1 2/20 0.47
PTGES O14684 2/20 0.47
ALOX5 P09917 2/20 0.47
HTR2C P28335 1/20 0.47
SLC6A4 P31645 1/20 0.47
HTR2B P41595 1/20 0.47
HTR6 P50406 1/20 0.47

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
SCHEMBL17912846 0.84 NPC1 (0.47) NPC1RAB9AMAOAMAOBPPARG
SCHEMBL19612452 0.84 NPC1 (0.47) NPC1RAB9AMAOAMAOBPPARG
SCHEMBL10795825 0.84 NPC1 (0.47) NPC1RAB9AMAOAMAOBFFAR1
SCHEMBL12260613 0.82 HPGD (0.49) PPARGPPARAHPGDGPR84PPARD
SCHEMBL14586643 0.82 MAPT (0.61) NPC1RAB9APPARGPPARAHPGD
SCHEMBL17912848 0.82 NPC1 (0.51) NPC1RAB9AMAOAMAOBHPGD
SCHEMBL11360859 0.82 NPC1 (0.56) NPC1RAB9AMAOAMAOBPPARG
Hydrochloric Acid SCHEMBL11354651 0.81 NPC1 (0.54) NPC1RAB9AMAOAMAOBHPGD
SCHEMBL9705397 0.80 L3MBTL1 (0.51) NPC1RAB9AHPGD
SCHEMBL19612420 0.80 RAB9A (0.53) NPC1RAB9AMAOAMAOBPPARG

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed