SCHEMBL16280446

SCHEMBL16280446

Nc1nc2c(Oc3cccc([N+](=O)[O-])c3)cccn2n1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.43
MAPT P10636 4/20 0.41
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 3/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
HPGD P15428 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
F10 P00742 1/20 0.39
TNK2 Q07912 1/20 0.38
PDE7A Q13946 1/20 0.38
NUDT1 P36639 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL16280573 0.86 MAPT (0.41) JAK2MAPTLMNAPKMRAB9A
SCHEMBL4286269 0.79 ALDH1A1 (0.45) MAPTLMNARAB9AALDH1A1ABCG2
SCHEMBL4292919 0.75 ALDH1A1 (0.47) MAPTLMNAPKMRAB9AALDH1A1
SCHEMBL11453175 0.73 LMNA (0.57) MAPTLMNAALDH1A1ABCG2HPGD
SCHEMBL23422083 0.71 ALDH1A1 (0.42) MAPTLMNARAB9AALDH1A1ABCG2
SCHEMBL29715554 0.71 ALDH1A1 (0.42) MAPTLMNARAB9AALDH1A1ABCG2
SCHEMBL7706101 0.71 HTT (0.58) MAPTLMNAALDH1A1HPGDMEN1
SCHEMBL23293751 0.71 ALDH1A1 (0.48) MAPTLMNAALDH1A1ABCG2MEN1
SCHEMBL10596737 0.70 MEN1 (0.56) MAPTLMNAALDH1A1ABCG2HPGD
SCHEMBL4203388 0.70 TSHR (0.67) MAPTLMNAALDH1A1ABCG2MEN1

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-20140364438-A1 TRIAZOLOPYRIDINE DERIVATIVES AS A TYROSINE KINASE INHIBITOR HANMI PHARM. CO., LTD. (KR) 2014-12-11 US disclosed
US-20140364438-A1 TRIAZOLOPYRIDINE DERIVATIVES AS A TYROSINE KINASE INHIBITOR HANMI PHARM. CO., LTD. (KR) 2014-12-11 US disclosed
US-20140364438-A1 TRIAZOLOPYRIDINE DERIVATIVES AS A TYROSINE KINASE INHIBITOR HANMI PHARM. CO., LTD. (KR) 2014-12-11 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-20140364438-A1 TRIAZOLOPYRIDINE DERIVATIVES AS A TYROSINE KINASE INHIBITOR LCK, TYK2, LTK JAK2 40/4885MAPT 1810/4885LMNA 4528/4885

“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.