SCHEMBL9350462

SCHEMBL9350462

O=C(O)C1=CCC(C(=O)O)=C(Nc2ccccc2)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ FABP4 P15090 1/20 0.37
▸ MAPK13 O15264 1/20 0.36
▸ MAPK12 P53778 1/20 0.36
▸ MAPK11 Q15759 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ MAPT P10636 9/20 0.35
▸ GFER P55789 3/20 0.35
▸ GAA P10253 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ ALDH1A1 P00352 6/20 0.35
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ PTPN7 P35236 1/20 0.35
▸ PTPN12 Q05209 1/20 0.35
▸ NGLY1 Q96IV0 1/20 0.35
▸ AKR1C3 P42330 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ HSD17B10 Q99714 3/20 0.34

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
SCHEMBL1415624 0.81 CASP3 (0.45) CASP3SENP7FABP4MAPK13MAPK12
SCHEMBL10582051 0.79 MAPT (0.44) MAPTGAAPOLBALDH1A1MEN1
SCHEMBL28825749 0.72 HPGD (0.55) CASP3SENP7MAPK13MAPK12MAPK11
SCHEMBL7621011 0.71 MAPT (0.49) CASP3MAPTGAAPOLBALDH1A1
SCHEMBL3909905 0.68 MAPT (0.53) MAPTGAAPOLBALDH1A1MEN1
SCHEMBL3909913 0.67 MAPT (0.49) CASP3MAPTGAAALDH1A1MEN1
SCHEMBL9065020 0.67 MAPT (0.48) MAPTGAAALDH1A1MEN1KMT2A
SCHEMBL10964731 0.67 CASP3 (0.47) CASP3SENP7MAPK13MAPK12MAPK11
SCHEMBL8131373 0.66 CYP1A2 (0.39) MAPTPOLBALDH1A1MEN1KMT2A
SCHEMBL30640267 0.66 CYP1A2 (0.39) MAPTPOLBALDH1A1MEN1KMT2A

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-5367096-A Process for the preparation of 2,5-di(phenylamino)terephthalic acid and dialkyl esters thereof in high purity HOECHST AKTIENGESELLSCHAFT (DE) 1994-11-22 — — US claimed
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