SCHEMBL3886158

SCHEMBL3886158

Cc1c(Cl)nc2c(SC#N)cnn2c1Nc1ccc(F)c(Cl)c1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 7/20 0.42
CDK2 P24941 6/20 0.42
CHEK2 O96017 1/20 0.42
CDK1 P06493 1/20 0.42
CSNK1D P48730 1/20 0.42
CDK5 Q00535 1/20 0.42
MAPKAPK3 Q16644 1/20 0.42
EGFR P00533 5/20 0.39
KDR P35968 4/20 0.39
APP P05067 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.36
GRM4 Q14833 1/20 0.36
KCNN3 Q9UGI6 1/20 0.36
STK17A Q9UEE5 1/20 0.36
BCDIN3D Q7Z5W3 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
SCHEMBL3197157 0.71 CDK2 (0.47) MAPKAPK2CDK2CHEK2CDK1CSNK1D
SCHEMBL3203580 0.68 MAPKAPK2 (0.49) MAPKAPK2CDK2EGFRKDRAPP
SCHEMBL5489325 0.62 CDK2 (0.38) CDK2
SCHEMBL1916553 0.61 MAPK1 (0.46) EGFRKDRAPPGRM4STK17A
SCHEMBL12813342 0.57 STK17A (0.57) EGFRKDRAPPRAPGEF4GRM4
SCHEMBL656032 0.57 SYK (0.72) CDK2CDK1CSNK1DCDK5KDR
SCHEMBL14871792 0.57 MAPKAPK2 (0.47) MAPKAPK2CDK2EGFRKDRGRM4
SCHEMBL9494328 0.57 MEN1 (0.52) RAPGEF4
SCHEMBL1392126 0.56 APP (0.77) APPRAPGEF4GRM4STK17A
SCHEMBL6644848 0.56 EGFR (0.48) EGFRGRM4

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-7557110-B2 MAPKAP-K2; inflammatory disease, autoimmune disease, destructive bone disorder, cancer and/or tumour growth; 5-[(trans-4-aminocyclohexyl)amino]-3-fluoro-6-methyl(pyrazolo[1,5-a]pyri- midin-7-yl)}(4-iodophenyl)amine TEIJIN PHARMA LIMITED (JP) 2009-07-07 US disclosed
EP-1780212-A1 PYRAZOLO[1,5-a]PYRIMIDINE DERIVATIVE Teijin Pharma Limited (JP) 2007-05-02 EP disclosed
US-20060189632-A1 Pyrazolo[1,5-A] pyrimidine derivatives TEIJIN PHARMA LIMITED (JP) 2006-08-24 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-20060189632-A1 Pyrazolo[1,5-A] pyrimidine derivatives MAP3K1, MAP3K5, MAP3K15 MAPKAPK2 35/4885CDK2 50/4885CHEK2 94/4885

“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.