SCHEMBL9984336

SCHEMBL9984336

Nc1ccc(Nc2nc(Cl)ccc2[N+](=O)[O-])cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.52
FGFR4 P22455 3/20 0.50
PIN1 Q13526 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.45
GSK3B P49841 2/20 0.43
PDE7A Q13946 2/20 0.42
RPS6KB2 Q9UBS0 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MCL1 Q07820 1/20 0.41
PTK2B Q14289 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ROCK1 Q13464 1/20 0.40
FGFR1 P11362 1/20 0.40

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
SCHEMBL22719050 0.89 MAPT (0.54) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL29535826 0.89 MAPT (0.54) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL718271 0.87 MAPT (0.51) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL9984006 0.87 MAPT (0.55) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL12705359 0.87 FGFR4 (0.52) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL1600402 0.86 PIN1 (0.65) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL13570477 0.85 FGFR4 (0.54) MAPTFGFR4PIN1MEN1KMT2A
Hydrochloric Acid SCHEMBL2175428 0.84 FGFR4 (0.53) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL15653997 0.84 MAPT (0.51) MAPTFGFR4PIN1MEN1KMT2A
SCHEMBL16739538 0.83 FGFR4 (0.65) MAPTFGFR4PIN1MAPK1HTT

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-20110306606-A1 NOVEL 2,6-SUBSTITUTED-3-NITROPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION INCLUDING SAME DONG WHA PHARM. CO., LTD. (KR) 2011-12-15 US disclosed
EP-2394993-A2 NOVEL 2,6-SUBSTITUTED-3-NITROPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION INCLUDING SAME Dong Wha Pharm. Co., Ltd. (KR) 2011-12-14 EP 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-20110306606-A1 NOVEL 2,6-SUBSTITUTED-3-NITROPYRIDINE DERIVATIVE, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION INCLUDING SAME NOS3, PTMS, NOS2 MAPT 4055/4885FGFR4 1689/4885PIN1 4490/4885

“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.