SCHEMBL3883718

SCHEMBL3883718

Nc1nnc(-c2ccncc2Nc2ccc(I)cc2F)o1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 18/20 0.42
MAP2K2 P36507 5/20 0.42
PRKCZ Q05513 1/20 0.42
IARS2 Q9NSE4 1/20 0.42
IDO1 P14902 1/20 0.35

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
SCHEMBL5481054 0.86 MAP2K1 (0.42) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5474880 0.86 DGAT1 (0.40) MAP2K1MAP2K2IDO1
SCHEMBL5477797 0.86 IDO1 (0.40) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5485313 0.86 TDO2 (0.38) MAP2K1IDO1
SCHEMBL5477603 0.84 MAP2K1 (0.41) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5486405 0.83 MAP2K1 (0.40) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5474208 0.83 KDM4E (0.43)
SCHEMBL27905778 0.83 MAP2K1 (0.42) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL3883639 0.83 MAP2K1 (0.40) MAP2K1MAP2K2PRKCZIARS2IDO1
SCHEMBL5481433 0.82 MAP2K1 (0.39) 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070287737-A1 Novel heteroaryl-substituted arylaminopyridine derivatives as MEK inhibitors MERCK SERONO SA (CH) 2007-12-13 US claimed
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
CN-101426766-A Novel heteroaryl substituted arylaminopyridine derivatives as MEK inhibitors SERONO LAB (CH) 2009-05-06 CN disclosed
EP-2013180-A1 NOVEL HETEROARYL-SUBSTITUTED ARYLAMINOPYRIDINE DERIVATIVES AS MEK INHIBITORS Laboratoires Serono SA (CH) 2009-01-14 EP 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
WO-2007123936-A1 NOVEL HETEROARYL-SUBSTITUTED ARYLAMINOPYRIDINE DERIVATIVES AS MEK INHIBITORS LABORATOIRES SERONO SA (CH) 2007-11-01 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-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.