SCHEMBL7553876

SCHEMBL7553876

C=CCOc1cnc(-c2ccc(-c3ccc(/C=C/CCCC(C)F)cc3)cc2)nc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL7553881 1.00 NPC1 (0.34) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7555055 0.99 NPC1 (0.34) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7555050 0.99 NPC1 (0.34) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7554850 0.94 NPC1 (0.37) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7562655 0.94 NPC1 (0.37) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7562650 0.94 NPC1 (0.37) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7554846 0.94 NPC1 (0.37) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7561169 0.92 NPC1 (0.34) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7561173 0.92 NPC1 (0.34) NPC1TP53RAB9AKDM4EALDH1A1
SCHEMBL7556617 0.91 NPC1 (0.35) NPC1TP53RAB9AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0708165-B1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL CO (JP) 2002-01-09 EP disclosed
US-6246452-B1 FERROELECTRIC CHIRAL SMECTIC LIQUID CRYSTAL MIXTURE HAVING IMPROVED RESPONSE SPEED WHICH CAN BE USED AS AN OPTICAL SHUTTER OR DISPLAY DEVICE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-06-12 US disclosed
EP-0667384-B1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL CO (JP) 1998-12-16 EP disclosed
EP-0708165-A1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-04-24 EP disclosed
EP-0667384-A1 Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-08-16 EP disclosed