SCHEMBL11422142

SCHEMBL11422142

Cc1cc(C(=O)Nc2cccc3c(O)ccc(S(=O)(=O)O)c23)ccc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
LMNA P02545 3/20 0.52
HTT P42858 1/20 0.52
ALDH1A1 P00352 5/20 0.49
HPGD P15428 2/20 0.49
KLF10 Q13118 1/20 0.49
POLB P06746 3/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
GAA P10253 3/20 0.47
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
CD40 P25942 1/20 0.46
CD40LG P29965 1/20 0.46
ENPP3 O14638 1/20 0.44
ENTPD3 O75355 1/20 0.44
NR1I2 O75469 1/20 0.44
USP2 O75604 1/20 0.44
PRKD3 O94806 1/20 0.44

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 0.92 MAPT (0.52) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11424949 0.92 HPGD (0.59) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11426564 0.89 HPGD (0.55) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11433945 0.89 HPGD (0.55) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11431850 0.88 HPGD (0.62) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11423955 0.88 HPGD (0.52) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11430244 0.85 MAPT (0.53) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11424306 0.84 MAPT (0.57) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11422144 0.84 KCNMA1 (0.48) MAPTLMNAHTTALDH1A1HPGD
SCHEMBL11437898 0.84 HPGD (0.59) MAPTLMNAHTTALDH1A1HPGD

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