SCHEMBL9467915

SCHEMBL9467915

O=[C]C(NC(=O)c1cc(=O)c(O)c[nH]1)c1ccc(O)cc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.38
▸ EGLN1 Q9GZT9 1/20 0.36
▸ TYR P14679 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HSD17B2 P37059 1/20 0.31
▸ EPHX2 P34913 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL9347342 0.90 EGLN1 (0.43) APPEGLN1TYRALDH1A1MAPT
SCHEMBL9347044 0.74 APP (0.32) APP
SCHEMBL9348191 0.73 SCN5A (0.31) —
SCHEMBL8075796 0.73 GFER (0.46) TYRALDH1A1MAPTGAASMN1; SMN2
SCHEMBL9875866 0.68 ALDH1A1 (0.47) APPEGLN1ALDH1A1MAPTGAA
SCHEMBL9661686 0.67 SMN1; SMN2 (0.36) ALDH1A1MAPTHSD17B2GAASMN1; SMN2
SCHEMBL9795277 0.66 HPGDS (0.49) ALDH1A1GAA
SCHEMBL8621358 0.66 TACR3 (0.34) ALDH1A1MAPTHSD17B2GAASMN1; SMN2
SCHEMBL9142124 0.66 ALDH1A1 (0.33) ALDH1A1HSD17B2SMN1; SMN2
Hydrochloric Acid SCHEMBL9658601 0.65 TDP1 (0.42) APPALDH1A1MAPTGAASMN1; SMN2

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-5185330-A Penicillins/ad/ TOYAMA CHEMICAL CO., LTD. (JP) 1993-02-09 — — US disclosed
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