SCHEMBL7517323

SCHEMBL7517323

CCCCCCCCC=Cc1cnc(-c2ccc(CCCCCCCCCC)c(F)c2F)nc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.36
F7 P08709 3/20 0.34
F3 P13726 3/20 0.34
MAPT P10636 3/20 0.34
MMP2 P08253 2/20 0.34
ALOX15 P16050 2/20 0.34
KDM4E B2RXH2 2/20 0.34
HSD17B10 Q99714 2/20 0.34
ECE1 P42892 1/20 0.34
SGMS1 Q86VZ5 1/20 0.34
SGMS2 Q8NHU3 1/20 0.34
MUS81 Q96NY9 1/20 0.34
SAE1 Q9UBE0 1/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TP53 P04637 1/20 0.34
CYP3A4 P08684 1/20 0.34
ALOX5 P09917 1/20 0.34
TYR P14679 1/20 0.34
TSHR P16473 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
SCHEMBL7511687 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL7517362 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL7511677 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL7513493 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL7517315 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL7517367 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL7513499 1.00 TNNC1 (0.36) TNNC1F7F3MAPTMMP2
SCHEMBL8665603 0.92 TNNC1 (0.32) TNNC1F7F3MAPTMMP2
SCHEMBL8570793 0.92 TNNC1 (0.32) TNNC1F7F3MAPTMMP2
SCHEMBL8571300 0.91 TNNC1 (0.33) TNNC1F7F3MAPTMMP2

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