SCHEMBL7552164

SCHEMBL7552164

C=CCc1ccc2nc(-c3ccc(CCCCCC(C)F)cc3)ccc2c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
KCNH2 Q12809 10/20 0.33
HRH3 Q9Y5N1 10/20 0.33
ALOX5 P09917 1/20 0.32
MAPT P10636 6/20 0.32
NPC1 O15118 1/20 0.32
STAT3 P40763 1/20 0.32
RAB9A P51151 1/20 0.32
ATM Q13315 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
DHODH Q02127 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
SCHEMBL7553388 0.96 KCNH2 (0.37) ESR1ESR2KCNH2HRH3MAPT
SCHEMBL8977263 0.85 TLR8 (0.42) MAPTNPC1STAT3RAB9AATM
SCHEMBL7555281 0.85 MAPT (0.42) MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL7551168 0.85 MAPT (0.38) KCNH2HRH3MAPTNPC1RAB9A
SCHEMBL7553151 0.84 PTGS2 (0.38) HRH3ALOX5MAPTSMN1; SMN2
SCHEMBL7558650 0.84 RAB9A (0.36) ALOX5MAPTNPC1STAT3RAB9A
SCHEMBL7554958 0.83 MAPT (0.32) ESR1ESR2ALOX5MAPT
SCHEMBL7554953 0.83 MAPT (0.32) ESR1ESR2ALOX5MAPT
SCHEMBL7556629 0.83 RAB9A (0.36) MAPTNPC1STAT3RAB9AATM
SCHEMBL8596925 0.83 RAB9A (0.41) MAPTNPC1STAT3RAB9AATM

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