SCHEMBL5478784

SCHEMBL5478784

NC(=O)CNc1nnc(-c2ccncc2Nc2ccc(I)cc2F)o1

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 19/20 0.44
MAP2K2 P36507 6/20 0.44
PRKCZ Q05513 1/20 0.44
IARS2 Q9NSE4 1/20 0.44
IDO1 P14902 1/20 0.36

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
SCHEMBL5479864 0.91 MAP2K1 (0.45) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL3883814 0.89 MAP2K1 (0.43) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5481252 0.88 MAP2K1 (0.42) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5483264 0.85 MAP2K1 (0.46) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5486451 0.83 MAP2K1 (0.44) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5477954 0.82 MAP2K1 (0.57) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5477603 0.82 MAP2K1 (0.41) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5478055 0.81 MAP2K1 (0.38) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5474260 0.81 MAP2K1 (0.42) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5481450 0.80 MAP2K1 (0.44) MAP2K1MAP2K2PRKCZIARS2IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8076486-B2 Heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO S.A. (CH) 2011-12-13 US disclosed
US-8076486-B2 Heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO S.A. (CH) 2011-12-13 US disclosed
US-8076486-B2 Heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO S.A. (CH) 2011-12-13 US disclosed
US-20070287737-A1 Novel heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 US disclosed
US-20070287737-A1 Novel heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 US disclosed
US-20070287737-A1 Novel heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 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-20070287737-A1 Novel heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors NRAS, MAP3K5, MAP3K1 MAP2K1 40/4885MAP2K2 27/4885PRKCZ 1154/4885

“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.