SCHEMBL14035915

SCHEMBL14035915

O=C(OCCc1cccc2ccccc12)C(F)(F)OOS

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.42
CDYL Q9Y232 1/20 0.42
MTNR1A P48039 2/20 0.41
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
KDM4E B2RXH2 2/20 0.40
FFAR4 Q5NUL3 1/20 0.38
CTNNB1 P35222 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MCL1 Q07820 2/20 0.36
GRM2 Q14416 1/20 0.36
GRM3 Q14832 1/20 0.36
ACP3 P15309 1/20 0.36

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
SCHEMBL14035904 0.87 EPHX1 (0.44) TRPV1MTNR1ATDP1CTNNB1ACP3
SCHEMBL14035918 0.84 KDM4E (0.46) TDP1KDM4EALDH1A1MCL1
SCHEMBL12128700 0.81 CDYL (0.48) TRPV1CDYLMTNR1ACHRM5CHRM1
SCHEMBL14035727 0.80 PPARG (0.45) TRPV1TDP1KDM4EALDH1A1
SCHEMBL13842667 0.79 TRPV1 (0.41) TRPV1CDYLMTNR1ACHRM5CHRM1
SCHEMBL14035681 0.78 HCAR2 (0.45) TDP1ALDH1A1
SCHEMBL107402 0.78 TRPV1 (0.43) TRPV1CDYLMTNR1ACHRM5CHRM1
SCHEMBL14035687 0.77 CYP1A2 (0.43)
SCHEMBL14009466 0.77 TRPV1 (0.42) TRPV1CDYLMTNR1ACHRM5CHRM1
SCHEMBL14035905 0.76 MTNR1A (0.37) TRPV1MTNR1ATDP1KDM4EALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080274426-A1 Using acrylic ester and sulfonium said salt; high resolution semiconductors; microfabrication patterns; excimer laser lithography SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-11-06 US disclosed