SCHEMBL10414259

SCHEMBL10414259

C=CC(=O)NNc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.71
▸ ALDH1A1 P00352 9/20 0.68
▸ GAA P10253 8/20 0.68
▸ MAPT P10636 6/20 0.68
▸ KMT2A Q03164 5/20 0.68
▸ MEN1 O00255 3/20 0.68
▸ TDP1 Q9NUW8 3/20 0.68
▸ KDM4E B2RXH2 1/20 0.68
▸ POLB P06746 1/20 0.68
▸ SMN1; SMN2 Q16637 5/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ LMNA P02545 2/20 0.50
▸ ALOX12 P18054 2/20 0.50
▸ HTT P42858 2/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ HPGD P15428 2/20 0.49
▸ PKM P14618 1/20 0.49
▸ RECQL P46063 1/20 0.46
▸ HSD17B10 Q99714 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
SCHEMBL3919472 0.83 TGM2 (1.00) TGM2ALDH1A1GAAMAPTKMT2A
SCHEMBL31064998 0.81 KMT2A (0.56) TGM2ALDH1A1GAAMAPTKMT2A
SCHEMBL20984965 0.80 GAA (0.63) TGM2ALDH1A1GAAMAPTKMT2A
SCHEMBL28030547 0.79 ALDH1A1 (0.66) ALDH1A1GAAMAPTKMT2AMEN1
SCHEMBL3164409 0.77 ALDH1A1 (0.59) ALDH1A1GAAMAPTKMT2AMEN1
SCHEMBL424545 0.77 ALDH1A1 (0.59) ALDH1A1GAAMAPTKMT2AMEN1
SCHEMBL9461541 0.77 MAPT (0.55) TGM2ALDH1A1GAAMAPTKMT2A
SCHEMBL10414262 0.75 ALDH1A1 (0.60) ALDH1A1GAAMAPTKMT2AMEN1
SCHEMBL16986581 0.75 ALDH1A1 (0.67) ALDH1A1GAAMAPTKMT2AMEN1
SCHEMBL10069262 0.75 TGM2 (0.82) TGM2ALDH1A1GAAMAPTKMT2A

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-4892964-A Hydrazide-containing thermoplastic polymers exhibiting nonlinear optical response HOECHST CELANESE CORPORATION (US) 1990-01-09 — — US disclosed
US-4824219-A Hydrazide-containing thermoplastic polymers exhibiting nonlinear optical response HOECHST CELANESE CORPORATION (US) 1989-04-25 — — US disclosed
US-4818802-A Hydrazide-containing thermoplastic polymers exhibiting nonlinear optical response HOECHST CELANESE CORP. (US) 1989-04-04 — — US disclosed
EP-0306893-A2 Hydrazide-containing thermoplastic polymers exhibiting nonlinear optical response HOECHST CELANESE CORPORATION (US) 1989-03-15 — — EP disclosed
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