SCHEMBL1817755

SCHEMBL1817755

CCc1cc([N+](=O)[O-])cnc1N

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.59
HTT P42858 1/20 0.59
IDO1 P14902 1/20 0.47
MAPT P10636 6/20 0.44
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.39
CYP3A4 P08684 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
NOS3 P29474 1/20 0.38
NOS1 P29475 1/20 0.38
NOS2 P35228 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL5105572 0.88 POLB (0.50) POLBHTTIDO1MAPTALDH1A1
SCHEMBL28046347 0.81 HTT (0.42) POLBHTTIDO1MAPTALDH1A1
SCHEMBL5484368 0.79 IDO1 (0.46) POLBHTTIDO1MAPTALDH1A1
SCHEMBL1817196 0.79 HTT (0.50) POLBHTTIDO1MAPTALDH1A1
SCHEMBL9978505 0.79 HTT (0.50) POLBHTTIDO1MAPTALDH1A1
SCHEMBL1815323 0.79 POLB (0.50) POLBHTTIDO1MAPTALDH1A1
SCHEMBL913434 0.78 ALDH1A1 (0.53) POLBHTTIDO1MAPTALDH1A1
SCHEMBL9673645 0.77 POLB (0.49) POLBHTTIDO1MAPTALDH1A1
SCHEMBL987475 0.77 IDO1 (0.53) HTTIDO1MAPTALDH1A1LMNA
SCHEMBL29253722 0.76 KMT2A (0.51) POLBHTTMAPTALDH1A1LMNA

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
WO-2025051157-A1 PYRIDINE-2(1H)-KETONE PRMT5-MTA INHIBITOR, AND PHARMACEUTICAL COMPOSITION AND USE THEREOF 赛诺哈勃药业(成都)有限公司 2025-03-13 WO disclosed
US-20110212918-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
WO-2011060199-A1 BORON-CONTAINING SMALL MOLECULES ANACOR PHARMACEUTICALS, INC. (US) 2011-05-19 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-20110212918-A1 BORON-CONTAINING SMALL MOLECULES BCL6B, BCL6, BTD POLB 721/4885HTT 4165/4885IDO1 3398/4885

“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.