SCHEMBL11423955

SCHEMBL11423955

Cc1cc(C(=O)Nc2ccc(S(=O)(=O)O)c3cccc(O)c23)ccc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.52
MAPT P10636 7/20 0.50
LMNA P02545 3/20 0.50
HTT P42858 1/20 0.50
ALDH1A1 P00352 4/20 0.49
KLF10 Q13118 1/20 0.49
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
GAA P10253 1/20 0.47
RAB9A P51151 4/20 0.47
POLB P06746 3/20 0.47
NPC1 O15118 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
CYP1A2 P05177 2/20 0.47
USP2 O75604 2/20 0.47
TIMP3 P35625 2/20 0.47
RECQL P46063 2/20 0.47
HSD17B10 Q99714 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
ENPP3 O14638 1/20 0.47

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
SCHEMBL11439150 0.96 MAPT (0.52) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11426564 0.93 HPGD (0.55) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11426047 0.92 HPGD (0.62) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11433945 0.89 HPGD (0.55) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11437898 0.88 HPGD (0.59) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11422142 0.88 MAPT (0.52) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11424280 0.85 MAPT (0.51) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL11437122 0.85 HPGD (0.66) HPGDMAPTLMNAHTTALDH1A1
SCHEMBL10905389 0.85 TIMP3 (0.50) HPGDMAPTLMNAALDH1A1MEN1
SCHEMBL11341781 0.85 HPSE (0.55) HPGDMAPTLMNAALDH1A1MEN1

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