SCHEMBL15312372

SCHEMBL15312372

C#Cc1n[nH]c2cc(F)ccc12

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 14/20 0.51
MAPK1 P28482 2/20 0.44
MAPK6 Q16659 2/20 0.44
ITK Q08881 3/20 0.43
MAP2K7 O14733 2/20 0.43
HTR2A P28223 2/20 0.42
MAPKAPK2 P49137 1/20 0.42
MAPKAPK3 Q16644 1/20 0.42
DAO P14920 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
SCHEMBL16252839 0.82 MAP2K4 (0.51) MAP2K4MAPK1MAPK6ITKMAP2K7
SCHEMBL24358756 0.79 PDPK1 (0.58)
SCHEMBL15312579 0.79 ITK (0.46) MAP2K4MAPK1MAPK6ITKMAP2K7
SCHEMBL5637837 0.79 MAP2K4 (0.44) MAP2K4DAO
SCHEMBL24358641 0.78 TRPA1 (0.51) MAP2K4MAPK1MAPK6MAPKAPK2MAPKAPK3
SCHEMBL9951795 0.73 KDM4E (0.52) MAP2K4ITKHTR2A
SCHEMBL220002 0.73 PDPK1 (0.60) MAP2K4MAPK1MAPK6ITKMAP2K7
SCHEMBL1573990 0.73 MAP2K4 (0.58) MAP2K4MAPK1MAPK6ITKMAP2K7
SCHEMBL2595185 0.72 MAP2K4 (0.56) MAP2K4MAPK1MAPK6ITKMAP2K7
SCHEMBL8212257 0.72 MAP2K4 (0.56) MAP2K4MAPK1MAPK6ITKMAP2K7

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
EP-2655357-B1 INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS MERCK SERONO SA (CH) 2016-06-22 EP disclosed
US-9073892-B2 Indazolyl triazol derivatives MERCK SERONO S.A. (CH) 2015-07-07 US disclosed
US-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES MERCK SERONO S.A. - INTELLECTUAL PROPERTY (CH) 2013-10-17 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-20130274241-A1 INDAZOLYL TRIAZOL DERIVATIVES NFATC1, IL5, CD4 MAP2K4 3270/4885MAPK1 1717/4885MAPK6 1588/4885

“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.