SCHEMBL10498783

SCHEMBL10498783

CCCCCCCc1ccc(C(=S)C=Cc2c(Br)cc(Br)cc2Br)cc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 6/20 0.45
▸ THRB P10828 6/20 0.45
▸ ATG4B Q9Y4P1 12/20 0.44
▸ PLA2G1B P04054 10/20 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
SCHEMBL9338032 0.82 THRA (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497528 0.82 THRA (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497516 0.81 THRA (0.44) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10498288 0.81 SLC6A19 (0.45) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10498179 0.81 THRA (0.46) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10498857 0.81 THRA (0.48) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497933 0.81 THRA (0.43) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497849 0.80 PLK1 (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497802 0.80 THRA (0.45) 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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