SCHEMBL11433674

SCHEMBL11433674

Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(O)cccc3c2S(=O)(=O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 7/20 0.54
▸ RAB9A P51151 4/20 0.44
▸ LMNA P02545 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ KMT2A Q03164 3/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ USP2 O75604 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ TNF P01375 1/20 0.42
▸ NOD1 Q9Y239 1/20 0.42
▸ SLC5A1 P13866 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ NCOA3 Q9Y6Q9 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL11423371 0.92 KCNMA1 (0.57) KCNMA1RAB9ALMNATSHRHSD17B10
SCHEMBL11442390 0.86 KCNMA1 (0.54) KCNMA1RAB9ALMNAKMT2AMEN1
SCHEMBL11426181 0.85 LMNA (0.47) KCNMA1RAB9ALMNATSHRHSD17B10
SCHEMBL11433673 0.84 HPGD (0.52) RAB9ALMNAKMT2AMEN1GAA
SCHEMBL11426568 0.84 KCNMA1 (0.54) KCNMA1RAB9ALMNAKMT2AMEN1
SCHEMBL11430407 0.84 KCNMA1 (0.47) KCNMA1KMT2AMEN1GAASMN1; SMN2
SCHEMBL11421980 0.84 KCNMA1 (0.51) KCNMA1RAB9ALMNAKMT2AMEN1
SCHEMBL11423958 0.83 KCNMA1 (0.53) KCNMA1RAB9ALMNAKMT2AMEN1
SCHEMBL11423367 0.83 HPGD (0.61) RAB9ALMNAKMT2AMEN1SMN1; SMN2
SCHEMBL11433946 0.82 KCNMA1 (0.52) KCNMA1RAB9ALMNAKMT2AMEN1

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-4216166-A Nitro precursors to amine precursors to ureide inhibitors of connective tissue destruction AMERICAN CYANAMID COMPANY (US) 1980-08-05 — — US disclosed
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