SCHEMBL14615280

SCHEMBL14615280

Cc1ccc(C(=O)Nc2ccc(Cl)c(-c3nc4ccccc4[nH]3)c2)cc1[N+](=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 1/20 0.66
▸ MAPT P10636 5/20 0.64
▸ KMT2A Q03164 3/20 0.63
▸ MEN1 O00255 2/20 0.63
▸ HTT P42858 2/20 0.63
▸ KDM4E B2RXH2 1/20 0.63
▸ ALDH1A1 P00352 1/20 0.63
▸ MCL1 Q07820 1/20 0.60
▸ SMN1; SMN2 Q16637 1/20 0.60
▸ TP53 P04637 1/20 0.58
▸ RXFP1 Q9HBX9 1/20 0.58
▸ RECQL P46063 1/20 0.57
▸ BLM P54132 1/20 0.57
▸ CACNA1B Q00975 1/20 0.57
▸ APBA1 Q02410 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ LMNA P02545 1/20 0.56
▸ GAA P10253 1/20 0.56

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
SCHEMBL14642397 0.84 MEN1 (0.61) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL15558128 0.81 MEN1 (0.54) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL15424140 0.81 MEN1 (0.73) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL15558259 0.80 MEN1 (0.71) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL13679543 0.80 MAPT (0.79) IRAK4MAPTKMT2AMEN1HTT
SCHEMBL13679611 0.80 MEN1 (0.74) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL13679601 0.79 MAPT (0.82) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL15424138 0.79 MAPT (0.75) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL14642442 0.79 MEN1 (0.79) MAPTKMT2AMEN1HTTKDM4E
SCHEMBL5820403 0.78 MAPT (0.74) MAPTKMT2AMEN1HTTKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8772275-B2 Mediators of hedgehog signaling pathways, compositions and uses related thereto CURIS, INC. (US) 2014-07-08 — — US disclosed
US-8772275-B2 Mediators of hedgehog signaling pathways, compositions and uses related thereto CURIS, INC. (US) 2014-07-08 — — US disclosed
US-8354397-B2 Controlling cell differentiation, cell proliferation; anticancer agents CURIS, INC. (US) 2013-01-15 — — US disclosed
US-8354397-B2 Controlling cell differentiation, cell proliferation; anticancer agents CURIS, INC. (US) 2013-01-15 — — US disclosed
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