SCHEMBL4916892

SCHEMBL4916892

O=C(NO)c1ccccc1C(=O)Nc1cccnc1[N+](=O)[O-]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
LMNA P02545 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
RAB9A P51151 3/20 0.47
HTT P42858 2/20 0.47
NPC1 O15118 2/20 0.47
KCNMA1 Q12791 1/20 0.47
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
KDR P35968 3/20 0.43
TP53 P04637 1/20 0.43
SNCA P37840 1/20 0.43
GAA P10253 1/20 0.43
NCOA1 Q15788 1/20 0.43
NCOA3 Q9Y6Q9 1/20 0.43
PABPC1 P11940 1/20 0.42
EIF4H Q15056 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42

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
SCHEMBL4921272 0.94 KMT2A (0.47) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL4916917 0.89 KDR (0.47) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL9637625 0.79 NPC1 (0.56) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL28898320 0.78 KMT2A (0.47) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL10745616 0.77 KMT2A (0.53) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL4930503 0.77 SHMT2 (0.48) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL4920375 0.73 HDAC6 (0.55) KMT2ASMN1; SMN2HDAC6
SCHEMBL25838729 0.72 NPC1 (0.49) KMT2AMEN1LMNASMN1; SMN2RAB9A
SCHEMBL11011727 0.72 PLK1 (0.47) KMT2AMEN1LMNAKDM4EKDR
SCHEMBL986256 0.72 HTT (0.65) KMT2AMEN1SMN1; SMN2RAB9AHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080269282-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2008-10-30 US disclosed
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2007-03-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269282-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof AOC2, AOC3, AOC1 KMT2A 3374/4885MEN1 1562/4885LMNA 4560/4885
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof AOC2, AOC3, AOC1 KMT2A 3243/4885MEN1 1683/4885LMNA 4579/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.