SCHEMBL9791195

SCHEMBL9791195

CCCCCCc1cccc(C)c1/C=C/C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BID P55957 6/20 0.52
▸ MCL1 Q07820 6/20 0.52
▸ BCL2L1 Q07817 5/20 0.52
▸ BAK1 Q16611 5/20 0.52
▸ PPARA Q07869 3/20 0.52
▸ KAT8 Q9H7Z6 2/20 0.52
▸ SAE1 Q9UBE0 2/20 0.52
▸ PPARG P37231 2/20 0.52
▸ EP300 Q09472 1/20 0.52
▸ KAT2A Q92830 1/20 0.52
▸ KAT2B Q92831 1/20 0.52
▸ KAT5 Q92993 1/20 0.52
▸ F7 P08709 3/20 0.49
▸ F3 P13726 3/20 0.49
▸ MMP2 P08253 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ ALOX15 P16050 1/20 0.49
▸ ECE1 P42892 1/20 0.49
▸ SGMS1 Q86VZ5 1/20 0.49

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
SCHEMBL9791191 0.83 BID (0.49) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL9791192 0.83 BID (0.49) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL9791187 0.82 THRA (0.43) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL9791188 0.81 BID (0.52) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL7745169 0.79 BID (0.45) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL291771 0.78 PTGER3 (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL3684323 0.78 PTGER3 (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL3250731 0.78 PTGER3 (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL2356096 0.78 PTGER3 (0.54) BIDMCL1BCL2L1BAK1PPARA
SCHEMBL6437827 0.78 PTGER3 (0.54) BIDMCL1BCL2L1BAK1PPARA

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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