SCHEMBL10498154

SCHEMBL10498154

CCCCCCCCCCCCCc1ccc(C(=S)C=Cc2cccc(CC)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 5/20 0.44
▸ THRB P10828 5/20 0.44
▸ ATG4B Q9Y4P1 11/20 0.43
▸ PLA2G1B P04054 9/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL9342510 0.95 HDAC4 (0.43) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497777 0.95 THRA (0.46) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10498322 0.94 HDAC4 (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9339736 0.94 HDAC4 (0.44) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9338139 0.90 HDAC4 (0.47) THRATHRB
SCHEMBL10498768 0.89 THRA (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10497836 0.88 P4HB (0.47) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL10498288 0.88 SLC6A19 (0.45) THRATHRBATG4BPLA2G1BCYP1A2
SCHEMBL9342497 0.88 HDAC4 (0.43) THRATHRB
SCHEMBL9337818 0.87 HDAC4 (0.45) TDP1MEN1KMT2A

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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