SCHEMBL11433711

SCHEMBL11433711

Cc1ccc([N+](=O)[O-])c(C(=O)Nc2c(O)ccc3c(S(=O)(=O)O)cccc23)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 3/20 0.44
▸ ALDH1A1 P00352 3/20 0.43
▸ KMT2A Q03164 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ STAT3 P40763 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ POLB P06746 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ DDX3X O00571 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ GRM5 P41594 1/20 0.37
▸ SIRT6 Q8N6T7 1/20 0.37

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
SCHEMBL11421989 0.92 KCNMA1 (0.47) KCNMA1ALDH1A1KMT2ASMN1; SMN2STAT3
SCHEMBL11430336 0.90 KCNMA1 (0.48) KCNMA1ALDH1A1KMT2ASMN1; SMN2STAT3
SCHEMBL11430407 0.88 KCNMA1 (0.47) KCNMA1ALDH1A1KMT2ASMN1; SMN2STAT3
Acetic Acid SCHEMBL11430476 0.87 ALDH1A1 (0.46) KCNMA1ALDH1A1KMT2ASMN1; SMN2HPGD
SCHEMBL11424281 0.86 KCNMA1 (0.49) KCNMA1ALDH1A1KMT2ASMN1; SMN2HPGD
SCHEMBL11422042 0.86 KCNMA1 (0.48) KCNMA1ALDH1A1KMT2ASMN1; SMN2STAT3
SCHEMBL11439444 0.85 TTR (0.43) KCNMA1ALDH1A1KMT2AHPGDMAPT
SCHEMBL11425199 0.85 KCNMA1 (0.43) KCNMA1ALDH1A1KMT2ASMN1; SMN2STAT3
SCHEMBL11423138 0.85 CYP1A2 (0.44) KCNMA1ALDH1A1KMT2ASMN1; SMN2STAT3
SCHEMBL11433708 0.84 MEN1 (0.48) ALDH1A1KMT2ASMN1; SMN2HPGDMAPT

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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