SCHEMBL11262003

SCHEMBL11262003

CC(C)(C)OC(=O)NC(C(=O)O)c1ccc(O)c([N+](=O)[O-])c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 4/20 0.41
GRM8 O00222 3/20 0.41
GRM6 O15303 3/20 0.41
GRM7 Q14831 2/20 0.41
ALDH1A1 P00352 3/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
MAPK1 P28482 2/20 0.38
ALOX5 P09917 1/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 1/20 0.38
TP53 P04637 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
GPR35 Q9HC97 1/20 0.38

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
SCHEMBL11260747 0.86 GPR35 (0.43) GRM4GRM8CTSSCTSKMAPT
SCHEMBL23413926 0.86 GRM8 (0.46) GRM4GRM8GRM6ALDH1A1MAPT
SCHEMBL23413613 0.86 CTSS (0.39) CTSSCTSKMAPTPPARGPPARA
SCHEMBL10725965 0.83 YARS1 (0.47) CTSSCTSKGAAMAPTMAPK1
SCHEMBL3379479 0.81 PPARG (0.54) ALDH1A1CTSSCTSKGAAMAPT
SCHEMBL11353719 0.81 CTSS (0.44) CTSSCTSKMAPTPPARGPPARA
SCHEMBL3379484 0.81 PPARG (0.54) ALDH1A1CTSSCTSKGAAMAPT
SCHEMBL15743379 0.80 FOLH1 (0.54) CTSSCTSKFOLH1
SCHEMBL23447574 0.80 CTSS (0.43) ALDH1A1CTSSCTSKLMNATSHR
SCHEMBL10815323 0.80 S1PR3 (0.45) CTSSCTSKPPARGPPARAFOLH1

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
EP-0046734-A2 Aminohydroxyphenyl derivatives of cephalosporins, process for their preparation and pharmaceutical compositions containing them CIBA-GEIGY AG (CH) 1982-03-03 EP disclosed