SCHEMBL11437902

SCHEMBL11437902

Cc1ccc(C(=O)Nc2cccc3c(S(=O)(=O)O)ccc(O)c23)c([N+](=O)[O-])c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNMA1 Q12791 3/20 0.51
▸ SMN1; SMN2 Q16637 5/20 0.42
▸ NPC1 O15118 3/20 0.42
▸ RAB9A P51151 3/20 0.42
▸ USP2 O75604 1/20 0.42
▸ KMT2A Q03164 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ GAA P10253 1/20 0.41
▸ CRHBP P24387 1/20 0.41
▸ CRHR2 Q13324 1/20 0.41
▸ MAPT P10636 4/20 0.41
▸ LMNA P02545 2/20 0.41
▸ 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 3/20 0.41
▸ TDP1 Q9NUW8 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40

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
SCHEMBL11426050 0.96 KCNMA1 (0.56) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11424951 0.92 KCNMA1 (0.51) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11439152 0.92 KCNMA1 (0.48) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11437124 0.89 KCNMA1 (0.57) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11431691 0.89 KCNMA1 (0.54) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11720856 0.89 KCNMA1 (0.49) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11431851 0.88 KCNMA1 (0.53) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11423958 0.88 KCNMA1 (0.53) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11423105 0.85 KCNMA1 (0.49) KCNMA1SMN1; SMN2NPC1RAB9AUSP2
SCHEMBL11422144 0.84 KCNMA1 (0.48) KCNMA1SMN1; SMN2NPC1RAB9AUSP2

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
Send feedback