SCHEMBL7558650

SCHEMBL7558650

C=CCc1ccc2cc(-c3ccc(CCCCCC(C)F)cc3)ncc2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.36
NPC1 O15118 9/20 0.36
CASP3 P42574 4/20 0.36
SENP7 Q9BQF6 4/20 0.36
SMN1; SMN2 Q16637 6/20 0.36
MAPT P10636 4/20 0.36
STAT3 P40763 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
SENP8 Q96LD8 2/20 0.35
SENP6 Q9GZR1 2/20 0.35
NFKB1 P19838 2/20 0.32
NFKB2 Q00653 2/20 0.32
RELA Q04206 2/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 3/20 0.31
HPGD P15428 3/20 0.31
CNR2 P34972 2/20 0.31
ALOX5 P09917 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
SCHEMBL7552397 0.96 RAB9A (0.36) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL8596925 0.88 RAB9A (0.41) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL7553189 0.87 RAB9A (0.42) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL7556194 0.87 RAB9A (0.39) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL7553151 0.85 PTGS2 (0.38) SMN1; SMN2MAPTKDM4EALDH1A1HPGD
SCHEMBL8597872 0.85 SMN1; SMN2 (0.40) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL7558886 0.84 RAB9A (0.48) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL7552164 0.84 ESR1 (0.34) RAB9ANPC1SMN1; SMN2MAPTSTAT3
SCHEMBL7549802 0.84 RARB (0.36) RAB9ANPC1CASP3SENP7SMN1; SMN2
SCHEMBL8603247 0.84 GRIN2D (0.39) SMN1; SMN2MAPTKDM4EALDH1A1HPGD

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