SCHEMBL15097498

SCHEMBL15097498

CCCCCCCCCCCCc1ccc(SOC)cc1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.44
TYR P14679 3/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
HTT P42858 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 1/20 0.39
CNR2 P34972 2/20 0.38
PTGS2 P35354 4/20 0.37
HTR2A P28223 1/20 0.35
S1PR1 P21453 1/20 0.35
LIPG Q9Y5X9 1/20 0.35

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
SCHEMBL15097500 0.82 ALOX5 (0.41) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL15097488 0.81 S1PR1 (0.43) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL15097486 0.80 ALOX5 (0.43) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL15097510 0.78 AR (0.43) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL15097487 0.78 ALOX5 (0.38) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL15097508 0.77 TDP1 (0.45) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL11224282 0.76 ESR1 (0.47) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL21505683 0.75 TYR (0.53) ALOX5TYRMEN1KMT2ATSHR
SCHEMBL15097494 0.74 ESR1 (0.53) TSHRTP53CYP3A4ALDH1A1PTGS2
SCHEMBL22300606 0.74 TYR (0.51) ALOX5TYRMEN1KMT2ATSHR

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-20130177851-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-11 US disclosed