SCHEMBL31376960

SCHEMBL31376960

CCc1ccc(/C=C2\SC(=O)N(C/C=C/C(=O)OC(C)(C)C)C2=O)cc1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 5/20 0.55
▸ MYC P01106 4/20 0.54
▸ MAX P61244 3/20 0.54
▸ PPARG P37231 5/20 0.47
▸ CA9 Q16790 1/20 0.45
▸ KDR P35968 1/20 0.45
▸ BAG3 O95817 1/20 0.44
▸ PTPN1 P18031 1/20 0.43
▸ ACP1 P24666 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
SCHEMBL31376941 0.85 AKR1B1 (0.76) AKR1B1MYCMAXPPARGCA9
SCHEMBL17934500 0.79 MYC (0.64) AKR1B1MYCMAXPPARGKDR
SCHEMBL346076 0.77 MYC (0.75) AKR1B1MYCMAXPPARG
SCHEMBL346075 0.77 MYC (0.75) AKR1B1MYCMAXPPARG
SCHEMBL346014 0.76 MYC (0.77) AKR1B1MYCMAXPPARGKDR
SCHEMBL346013 0.76 MYC (0.77) AKR1B1MYCMAXPPARGKDR
SCHEMBL17934348 0.75 MYC (0.59) AKR1B1MYCMAXPPARGKDR
SCHEMBL346449 0.74 MYC (0.69) MYCMAXPPARG
SCHEMBL346448 0.74 MYC (0.69) MYCMAXPPARG
SCHEMBL346081 0.73 MYC (0.70) MYCMAXPPARG

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
WO-2025064325-A1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES, INC. (US) 2025-03-27 — — WO disclosed
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