SCHEMBL7514979

SCHEMBL7514979

CCCCCCCCOc1cnc(-c2ccc(CCCC(C)F)c(F)c2)nc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.41
KDM4E B2RXH2 4/20 0.41
NPC1 O15118 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CNR2 P34972 8/20 0.41
MAPT P10636 2/20 0.38
RARB P10826 3/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
HTT P42858 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PLA2G4A P47712 1/20 0.36
CNR1 P21554 1/20 0.35
MEN1 O00255 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL7512118 1.00 RAB9A (0.41) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7516127 1.00 RAB9A (0.41) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7514869 0.97 CNR2 (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7512063 0.97 CNR2 (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7511125 0.97 CNR2 (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7515666 0.97 CNR2 (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7515874 0.97 CNR2 (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7521071 0.97 CNR2 (0.43) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7515853 0.87 RARB (0.47) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL7515761 0.87 RARB (0.47) RAB9AKDM4ENPC1SMN1; SMN2HSD17B10

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 3 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-0708165-A1 Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-04-24 EP disclosed