SCHEMBL15097486

SCHEMBL15097486

CCCCCCCCCCCCc1c(F)cc(SOC)cc1F

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.43
TAAR1 Q96RJ0 1/20 0.36
CYP19A1 P11511 1/20 0.34
PTGS2 P35354 5/20 0.33
HTR2A P28223 1/20 0.33
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
TYR P14679 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
RARB P10826 2/20 0.33
RARA P10276 1/20 0.33
RARG P13631 1/20 0.33
GPR84 Q9NQS5 1/20 0.33

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
SCHEMBL15097515 0.80 ALOX5 (0.40) ALOX5CYP19A1PTGS2
SCHEMBL15097808 0.80 ALOX5 (0.37) ALOX5CYP19A1PTGS2
SCHEMBL15097498 0.80 ALOX5 (0.44) ALOX5PTGS2HTR2AMEN1TP53
SCHEMBL15097806 0.76 ALOX5 (0.37) ALOX5CYP19A1MAPTTDP1GPR84
SCHEMBL15097496 0.76 AR (0.40) ALOX5MEN1MAPTTSHRHTT
SCHEMBL21621119 0.76 ALOX5 (0.43) ALOX5CYP19A1PTGS2HTR2AMEN1
SCHEMBL15097502 0.74 ESR1 (0.39) ALOX5PTGS2MEN1MAPTHTT
SCHEMBL27959363 0.74 GCGR (0.41) ALOX5TAAR1CYP19A1PTGS2HTR2A
SCHEMBL21118429 0.72 PTGS2 (0.52) PTGS2HTR2ATP53CYP3A4HTT
SCHEMBL15097494 0.70 ESR1 (0.53) PTGS2HTR2ATP53CYP3A4TSHR

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