SCHEMBL11433673

SCHEMBL11433673

Cc1cc(C(=O)Nc2ccc3c(O)cccc3c2S(=O)(=O)O)ccc1[N+](=O)[O-]

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.52
▸ MAPT P10636 8/20 0.51
▸ MEN1 O00255 8/20 0.51
▸ KMT2A Q03164 8/20 0.51
▸ LMNA P02545 4/20 0.51
▸ HTT P42858 2/20 0.51
▸ GAA P10253 1/20 0.51
▸ RAB9A P51151 3/20 0.50
▸ SMN1; SMN2 Q16637 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ ALDH1A1 P00352 6/20 0.48
▸ POLB P06746 4/20 0.48
▸ KLF10 Q13118 1/20 0.48
▸ TP53 P04637 1/20 0.47
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ SAE1 Q9UBE0 1/20 0.46
▸ UBA2 Q9UBT2 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ MAPK1 P28482 1/20 0.46

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
SCHEMBL11423367 0.93 HPGD (0.61) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11442387 0.86 MEN1 (0.53) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL10907766 0.84 ALDH1A1 (0.43) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11344516 0.84 TRPV1 (0.49) MAPTMEN1KMT2ALMNAHTT
SCHEMBL11433674 0.84 KCNMA1 (0.54) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11430403 0.84 MEN1 (0.51) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11426564 0.84 HPGD (0.55) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11421978 0.84 MEN1 (0.52) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11426177 0.83 HPSE (0.42) HPGDMAPTMEN1KMT2ALMNA
SCHEMBL11442222 0.83 RAB9A (0.59) MAPTMEN1KMT2ARAB9ASMN1; 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-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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