SCHEMBL27564755

SCHEMBL27564755

COC(=O)c1csc(-c2ccc(N)cc2C(=O)OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.48
▸ MAPT P10636 6/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ HPGD P15428 4/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ ATM Q13315 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ MAPK1 P28482 2/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ CYP46A1 Q9Y6A2 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ ABCB1 P08183 1/20 0.38
▸ RAB9A P51151 2/20 0.37

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
SCHEMBL9705197 0.80 GAA (0.65) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL29473506 0.77 CA1 (0.48) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL25010859 0.75 GAA (0.48) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL20298727 0.72 APP (0.48) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL25011884 0.72 GAA (0.44) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL2726928 0.72 GAA (0.54) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL27875207 0.71 TSHR (0.43) MAPTALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1403643 0.71 GAA (0.72) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL5705033 0.71 CA2 (0.45) GAAMAPTALDH1A1KDM4EHPGD
SCHEMBL27858563 0.70 TSHR (0.42) MAPTALDH1A1KDM4EHPGDHSD17B10

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
CN-1371357-A Aminobenzoic acid derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 2002-09-25 — — CN disclosed
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