SCHEMBL9791139

SCHEMBL9791139

CCCCCCc1cccc(/C=C/C(=O)N(C)O)c1SC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BID P55957 3/20 0.40
▸ MCL1 Q07820 3/20 0.40
▸ BCL2L1 Q07817 2/20 0.40
▸ BAK1 Q16611 2/20 0.40
▸ KAT8 Q9H7Z6 2/20 0.40
▸ SAE1 Q9UBE0 2/20 0.40
▸ PPARA Q07869 2/20 0.40
▸ PPARG P37231 1/20 0.40
▸ EP300 Q09472 1/20 0.40
▸ KAT2A Q92830 1/20 0.40
▸ KAT2B Q92831 1/20 0.40
▸ KAT5 Q92993 1/20 0.40
▸ ALOX5 P09917 1/20 0.38
▸ F7 P08709 3/20 0.38
▸ F3 P13726 3/20 0.38
▸ MMP2 P08253 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ ECE1 P42892 1/20 0.38

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
SCHEMBL9791141 1.00 BID (0.40) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9791185 0.85 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9791180 0.85 BID (0.49) BIDMCL1BCL2L1BAK1KAT8
Hydrochloric Acid SCHEMBL9791255 0.84 BID (0.48) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9791248 0.84 BID (0.42) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9791251 0.84 BID (0.42) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9790959 0.81 ALOX5 (0.41) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9790962 0.81 ALOX5 (0.41) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9791050 0.81 BID (0.39) BIDMCL1BCL2L1BAK1KAT8
SCHEMBL9791055 0.81 BID (0.39) BIDMCL1BCL2L1BAK1KAT8

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-5028629-A 2-(Substituted)-N-Hydroxy-N-Alkylcinnamamides ELI LILLY AND COMPANY (US) 1991-07-02 — — US disclosed
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