SCHEMBL4052244

SCHEMBL4052244

C[Si](C)(C)c1[nH]nnc1-c1c(Nc2ccc(I)cc2F)cncc1-c1ccccc1F

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 17/20 0.33
MAP2K2 P36507 1/20 0.33
PRKCZ Q05513 1/20 0.33
IARS2 Q9NSE4 1/20 0.33
CHRM1 P11229 1/20 0.32
KDR P35968 1/20 0.31
FLT1 P17948 1/20 0.31

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
SCHEMBL4225150 0.80 MAP2K1 (0.42) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5477634 0.78 MAP2K1 (0.35) MAP2K1MAP2K2PRKCZIARS2CHRM1
SCHEMBL5481220 0.75 PIM1 (0.40) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5479878 0.71 MAP2K1 (0.42) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL3893004 0.70 MAP2K1 (0.44) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL3884857 0.69 MAP2K1 (0.45) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL3888960 0.69 MAP2K1 (0.51) MAP2K1MAP2K2
SCHEMBL3887156 0.68 MAP2K1 (0.47) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5484767 0.67 PIM1 (0.38) MAP2K1MAP2K2PRKCZIARS2
SCHEMBL5481433 0.62 MAP2K1 (0.39) MAP2K1MAP2K2PRKCZIARS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103121996-A Novel heteroaryl-substituted arylaminopyridine derivatives as mek inhibitors SERONO LAB 2013-05-29 CN claimed
CN-103121996-A Novel heteroaryl-substituted arylaminopyridine derivatives as mek inhibitors SERONO LAB 2013-05-29 CN 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
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
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.