SCHEMBL7554450

SCHEMBL7554450

C=CCOc1ccc(-c2cnc(CCCCCC(C)F)cn2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
L3MBTL1 Q9Y468 3/20 0.34
RAB9A P51151 3/20 0.34
CYP2D6 P10635 2/20 0.34
KDM4E B2RXH2 4/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
DCTPP1 Q9H773 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA7 P43166 1/20 0.31

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
SCHEMBL7558955 0.99 MAPT (0.33) MAPTL3MBTL1RAB9ACYP2D6KDM4E
SCHEMBL7555471 0.90 MAPT (0.42) MAPTL3MBTL1RAB9ACYP2D6KDM4E
SCHEMBL7554171 0.86 CYP2D6 (0.35) MAPTRAB9ACYP2D6KDM4EALDH1A1
SCHEMBL8600400 0.84 MCHR1 (0.38) MAPTL3MBTL1RAB9ACYP2D6KDM4E
SCHEMBL7559142 0.84 RAB9A (0.52) MAPTL3MBTL1RAB9ACYP2D6KDM4E
SCHEMBL7558363 0.84 RAB9A (0.36) MAPTL3MBTL1RAB9AKDM4EALDH1A1
SCHEMBL7943922 0.83 RAB9A (0.51) MAPTL3MBTL1RAB9ACYP2D6KDM4E
SCHEMBL7558386 0.83 RAB9A (0.35) MAPTL3MBTL1RAB9AKDM4EALDH1A1
SCHEMBL7556786 0.83 RAB9A (0.45) MAPTL3MBTL1RAB9ACYP2D6KDM4E
SCHEMBL7557596 0.83 RAB9A (0.45) MAPTL3MBTL1RAB9ACYP2D6KDM4E

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 6 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
US-5779934-A FLUORINATING AN ALCOHOL DERIVATIVE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-07-14 US 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