SCHEMBL9911283

SCHEMBL9911283

CNc1cc(C)ccc1Nc1nc(Nc2cc(CCC(=O)OC)ccc2OC)ncc1Cl

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 19/20 0.57
INSR P06213 16/20 0.57
LRRK2 Q5S007 1/20 0.49

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
SCHEMBL9911282 0.92 ALK (0.56) ALKINSRLRRK2
SCHEMBL1707212 0.82 ALK (0.60) ALKINSR
SCHEMBL9911281 0.77 MAPK3 (0.52) ALKINSRLRRK2
SCHEMBL10042754 0.75 LRRK2 (0.61) ALKINSRLRRK2
SCHEMBL9911266 0.75 LRRK2 (0.56) ALKINSRLRRK2
SCHEMBL1707663 0.75 ALK (0.56) ALKINSR
SCHEMBL12781588 0.74 ALK (0.57) ALKINSRLRRK2
SCHEMBL18159096 0.73 ALK (1.00) ALKINSR
SCHEMBL9911278 0.73 MAPK3 (0.47) ALKINSRLRRK2
SCHEMBL9911242 0.73 EGFR (0.55) ALKINSRLRRK2

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 ALK 2709/4885INSR 3571/4885LRRK2 3072/4885

“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.