SCHEMBL27319189

SCHEMBL27319189

Cc1onc(C(=O)Nc2ccc(O)cc2)c1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 1/20 0.49
▸ KMT2A Q03164 1/20 0.47
▸ PTGS2 P35354 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ LMNA P02545 2/20 0.46
▸ RECQL P46063 1/20 0.46
▸ TP53 P04637 2/20 0.45
▸ GAA P10253 1/20 0.45
▸ PRKCI P41743 1/20 0.44
▸ GHSR Q92847 1/20 0.44
▸ HIF1A Q16665 1/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 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
SCHEMBL27322188 0.85 PTGS2 (0.59) GFERKMT2APTGS2MAPK1SMN1; SMN2
SCHEMBL28148161 0.84 NPC1 (0.56) GFERPTGS2MAPK1SMN1; SMN2LMNA
SCHEMBL27315064 0.84 ALDH1A1 (0.50) GFERKMT2ALMNATP53
SCHEMBL27325273 0.84 KMT2A (0.54) GFERKMT2APTGS2MAPK1SMN1; SMN2
SCHEMBL27408901 0.84 KMT2A (0.49) GFERKMT2ASMN1; SMN2TP53CA12
SCHEMBL27311725 0.84 ALDH1A1 (0.48) GFERKMT2ALMNATP53GAA
SCHEMBL27318293 0.83 AKR1C3 (0.58) KMT2ALMNARECQL
SCHEMBL27318291 0.83 PKM (0.52) GFERKMT2ASMN1; SMN2LMNARECQL
SCHEMBL27309740 0.82 KMT2A (0.50) GFERKMT2APTGS2TP53HIF1A
SCHEMBL27315061 0.82 CYP1A2 (0.49) GFERKMT2ASMN1; SMN2CA12CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1051074-C Isoxazole-4-carboxamides and hydroxyalkylidenecyanoacetamides pharmaceuticals containing these compounds and their use HOECHST AG (DE) 2000-04-05 — — CN disclosed
CN-1056684-A Different  azoles-4-carboxylic acid amides and hydroxy alkylidene Malonamide nitrile contains the medicine of these compounds and their application HOECHST AG (DE) 1991-12-04 — — CN disclosed
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