SCHEMBL7552062

SCHEMBL7552062

C=CCc1ccc(-c2cnc(CCCCCC(C)F)nc2)cc1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
ALOX12 P18054 1/20 0.32
CNR2 P34972 1/20 0.32
PTGS2 P35354 1/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
STAT3 P40763 1/20 0.30
RAB9A P51151 1/20 0.30
ATM Q13315 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
SCHEMBL7555991 0.90 MAPT (0.34) SMN1; SMN2ALDH1A1TSHRNPC1MAPT
SCHEMBL7559220 0.89 CNR2 (0.33) CNR2PTGS2
SCHEMBL7559619 0.88 MEN1 (0.43) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL7552801 0.88 MEN1 (0.43) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL7556499 0.86 MCHR1 (0.32) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL7560812 0.85 TSHR (0.38) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL8603393 0.85 TSHR (0.38) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15
SCHEMBL7556534 0.84 RAB9A (0.43) SMN1; SMN2ALDH1A1TP53NPC1MAPT
SCHEMBL7559531 0.84 RAB9A (0.43) SMN1; SMN2ALDH1A1TP53NPC1MAPT
SCHEMBL7555580 0.84 SMN1; SMN2 (0.48) SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15

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