SCHEMBL9911277

SCHEMBL9911277

CNc1cc(C)ccc1Nc1nc(Nc2cnc(OCCO)cc2C)ncc1Cl

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 13/20 0.47
LRRK2 Q5S007 6/20 0.43
CCNK O75909 1/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41
CDK9 P50750 1/20 0.41

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
SCHEMBL9911269 0.83 MAPK3 (0.52) MAPK3LRRK2CCNKCCNA2CDK2
SCHEMBL1707393 0.79 ALK (0.49) MAPK3LRRK2
SCHEMBL9911281 0.77 MAPK3 (0.52) MAPK3LRRK2CCNKCCNA2CDK2
SCHEMBL9911263 0.76 LRRK2 (0.50) MAPK3LRRK2CCNKCCNA2CDK2
SCHEMBL9911274 0.76 MAPK3 (0.58) MAPK3LRRK2CCNKCCNA2CDK2
SCHEMBL9911268 0.76 MAPK3 (0.72) MAPK3LRRK2CCNKCCNA2CDK2
SCHEMBL9911271 0.75 MAPK3 (0.50) MAPK3LRRK2
SCHEMBL9911275 0.75 MAPK3 (0.50) MAPK3LRRK2
SCHEMBL9911272 0.74 LRRK2 (0.52) MAPK3LRRK2CCNKCCNA2CDK2
SCHEMBL9911273 0.74 MAPK3 (0.53) MAPK3LRRK2CCNKCCNA2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS CELLZOME LIMITED (GB) 2012-06-07 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-20120142667-A1 PYRIMIDINE DERIVATIVES AS ZAP-70 INHIBITORS ZAP70, LCK, DPY30 MAPK3 978/4885LRRK2 3072/4885CCNK 1250/4885

“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.