SCHEMBL10497802

SCHEMBL10497802

CCCCCCc1ccc(C(=S)C=Cc2c(F)c(F)cc(F)c2F)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 4/20 0.45
▸ THRB P10828 4/20 0.45
▸ RARB P10826 3/20 0.44
▸ RARA P10276 1/20 0.44
▸ RARG P13631 1/20 0.44
▸ ATG4B Q9Y4P1 11/20 0.44
▸ PLA2G1B P04054 9/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL10497733 0.93 THRA (0.43) THRATHRBRARBRARARARG
SCHEMBL10498857 0.91 THRA (0.48) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497849 0.88 PLK1 (0.47) THRATHRBRARBRARARARG
SCHEMBL10497791 0.86 PLK1 (0.46) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497389 0.81 THRA (0.44) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10498179 0.81 THRA (0.46) THRATHRBRARBATG4BPLA2G1B
SCHEMBL10498942 0.80 KCNK2 (0.43) THRATHRBRARBRARARARG
SCHEMBL10498783 0.80 THRA (0.45) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497532 0.80 THRA (0.52) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497709 0.80 THRA (0.52) THRATHRBATG4BPLA2G1BCYP1A2

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
EP-0328669-A1 CHALCONE DERIVATIVE COMPOUNDS NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1989-08-23 — — EP disclosed
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