SCHEMBL10497568

SCHEMBL10497568

CCCCCCCCCCCCCCCCCSc1ccc(C(=O)/C=C/c2ccc(C(C)=O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.52
▸ THRA P10827 1/20 0.49
▸ THRB P10828 1/20 0.49
▸ MAPT P10636 6/20 0.48
▸ LMNA P02545 4/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ POLB P06746 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ SENP8 Q96LD8 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48
▸ TUBB4A P04350 2/20 0.47
▸ TUBB P07437 2/20 0.47
▸ TUBA3C P0DPH7 2/20 0.47

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
SCHEMBL10497584 1.00 ABCG2 (0.52) ABCG2THRATHRBMAPTLMNA
SCHEMBL10497656 0.91 ABCG2 (0.45) ABCG2THRATHRBMAPTLMNA
SCHEMBL10871407 0.91 THRB (0.54) ABCG2THRATHRBMAPTLMNA
SCHEMBL10871409 0.91 THRB (0.54) ABCG2THRATHRBMAPTLMNA
SCHEMBL10871106 0.91 THRB (0.54) ABCG2THRATHRBMAPTLMNA
SCHEMBL10871104 0.91 THRB (0.54) ABCG2THRATHRBMAPTLMNA
SCHEMBL10497832 0.90 ABCG2 (0.65) ABCG2THRATHRBMAPTLMNA
SCHEMBL10498124 0.90 ABCG2 (0.65) ABCG2THRATHRBMAPTLMNA
SCHEMBL10497801 0.90 ABCG2 (0.65) ABCG2THRATHRBMAPTLMNA
SCHEMBL9342195 0.89 MAOB (0.56) ABCG2THRATHRBMAPTLMNA

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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