SCHEMBL7516630

SCHEMBL7516630

CCCCCCCCCOc1cnc(-c2ccc(CCCC(C)F)cc2F)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.40
RARB P10826 1/20 0.40
HDAC1 Q13547 2/20 0.35
HDAC6 Q9UBN7 2/20 0.35
HDAC5 Q9UQL6 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MEN1 O00255 2/20 0.35
USP2 O75604 2/20 0.35
ALDH1A1 P00352 2/20 0.35
RAB9A P51151 2/20 0.35
KMT2A Q03164 2/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
LMNA P02545 2/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 1/20 0.34
CASP1 P29466 1/20 0.34

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
SCHEMBL7514642 1.00 PLA2G4A (0.40) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7515526 1.00 PLA2G4A (0.40) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7525637 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7525022 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7510770 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL8566709 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7514377 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7524338 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7516426 0.97 RARB (0.42) PLA2G4ARARBHDAC1HDAC6HDAC5
SCHEMBL7520507 0.89 PLA2G4A (0.40) PLA2G4ARARBKDM4EMAPTCYP3A4

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