SCHEMBL14280760

SCHEMBL14280760

BC(=O)N/C(=C\c1ccncc1[N+](=O)[O-])C(=O)OC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.37
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
ALDH1A1 P00352 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
THRB P10828 1/20 0.35
POLB P06746 1/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL8274206 0.84 MAPT (0.43) MAPTNPSR1HTTGAAKMT2A
SCHEMBL4890326 0.84 MAPT (0.43) MAPTNPSR1HTTGAAKMT2A
SCHEMBL4890329 0.84 MAPT (0.43) MAPTNPSR1HTTGAAKMT2A
SCHEMBL22346562 0.81 MAPT (0.51) MAPTNPSR1HTTGAAKMT2A
SCHEMBL22346561 0.81 MAPT (0.51) MAPTNPSR1HTTGAAKMT2A
Potassium Ion SCHEMBL5226685 0.80 MAPT (0.50) MAPTNPSR1HTTGAAKMT2A
SCHEMBL8272679 0.73 MAPT (0.43) MAPTNPSR1HTTGAAKMT2A
SCHEMBL27619378 0.72 CCNC (0.50) MAPTHTTGAAKMT2AMEN1
SCHEMBL27555924 0.71 MAPT (0.70) MAPTNPSR1KMT2AMEN1LMNA
SCHEMBL4442808 0.71 ALDH1A1 (0.41) MAPTNPSR1KMT2AMEN1LMNA

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-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes ASTRAZENECA AB (SE) 2008-01-10 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 (1 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-20080009512-A1 Tetrahydroquinolones and Aza-Analogues Thereof for Use as Dpp-IV Inhibitors in the Treatment of Diabetes DPP4, DPP8, DPP3 MAPT 4846/4885NPSR1 2433/4885HTT 2723/4885

“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.