SCHEMBL7549802

SCHEMBL7549802

C=CCc1ccc2cc(-c3ncc(CCCCCC(C)F)cn3)ccc2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 1/20 0.36
MAPT P10636 6/20 0.35
RAB9A P51151 4/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 2/20 0.35
GAA P10253 2/20 0.35
KMT2A Q03164 2/20 0.35
USP2 O75604 1/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
SPHK1 Q9NYA1 1/20 0.32
NPC1 O15118 2/20 0.32
STAT3 P40763 1/20 0.32
ATM Q13315 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32

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
SCHEMBL8601971 0.96 RAB9A (0.35) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL8596925 0.89 RAB9A (0.41) MAPTRAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL7556286 0.89 RARB (0.42) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL7560939 0.88 RARB (0.41) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL7557298 0.86 RAB9A (0.45) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL7553151 0.86 PTGS2 (0.38) RARBMAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL8977266 0.85 RARB (0.48) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL7554359 0.85 RAB9A (0.44) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL8603584 0.85 SRC (0.34) RARBMAPTRAB9ASMN1; SMN2ALDH1A1
SCHEMBL7561445 0.85 SRC (0.40) RARBMAPTRAB9ASMN1; SMN2ALDH1A1

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 5 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-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