SCHEMBL1072166

SCHEMBL1072166

CNc1ccc([N+](=O)[O-])c(N)c1C(=O)OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.46
HTT P42858 2/20 0.43
MAPT P10636 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
KMT2A Q03164 3/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
ABCC4 O15439 1/20 0.42
PLIN1 O60240 1/20 0.42
CACNA1F O60840 1/20 0.42
GMNN O75496 1/20 0.42
KCNK2 O95069 1/20 0.42
ABCB11 O95342 1/20 0.42
GSR P00390 1/20 0.42
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CYP2D6 P10635 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
SCHEMBL4689028 0.81 TDP1 (0.44) HTTMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL1069184 0.81 TDP1 (0.53) HTTMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL1071311 0.81 KMT2A (0.43) HTTMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL1072292 0.78 HCAR3 (0.44) HCAR3HTTMAPTSMN1; SMN2KMT2A
SCHEMBL23413061 0.78 MAPT (0.49) MAPTSMN1; SMN2KMT2AKDM4EALDH1A1
SCHEMBL4694223 0.76 ALDH1A1 (0.43) HTTMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL4694230 0.76 ALDH1A1 (0.43) HTTMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL19700174 0.74 HCAR3 (0.45) HCAR3HTTMAPTSMN1; SMN2KMT2A
SCHEMBL5310060 0.73 KMT2A (0.47) HTTMAPTSMN1; SMN2KMT2AKDM4E
SCHEMBL223175 0.73 VCAM1 (0.57) HCAR3HTTMAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110039895-A1 PROLYL HYDROXYLASE INHIBITORS Glaxo Smith Kline LLC., a corporation 2011-02-17 US disclosed
EP-2273879-A1 PROLYL HYDROXYLASE INHIBITORS GlaxoSmithKline LLC (US) 2011-01-19 EP disclosed
WO-2009134850-A1 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-11-05 WO 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-20110039895-A1 PROLYL HYDROXYLASE INHIBITORS HIF1AN, EGLN3, EGLN2 HCAR3 967/4885HTT 2118/4885MAPT 4507/4885

“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.