SCHEMBL9911250

SCHEMBL9911250

COc1ccc(F)cc1Nc1ncc(Cl)c(Nc2ccc(C)cc2NS(C)(=O)=O)n1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 3/20 0.56
ALK Q9UM73 5/20 0.55
INSR P06213 1/20 0.55
EGFR P00533 12/20 0.54
MET P08581 1/20 0.53
LRRK2 Q5S007 1/20 0.53
ROS1 P08922 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
SCHEMBL9911252 0.94 MAPK3 (0.62) MAPK3EGFRMETLRRK2
SCHEMBL1707303 0.91 MAPK3 (0.56) MAPK3ALKINSREGFRMET
SCHEMBL9911242 0.90 EGFR (0.55) MAPK3ALKINSREGFRMET
SCHEMBL1707236 0.90 EGFR (0.55) MAPK3ALKINSREGFRMET
SCHEMBL9911246 0.87 EGFR (0.62) MAPK3ALKEGFRMETLRRK2
SCHEMBL10267495 0.86 EGFR (0.55) ALKEGFRMETLRRK2
SCHEMBL9911255 0.85 EGFR (0.58) MAPK3ALKEGFRMETLRRK2
SCHEMBL12726534 0.85 PTK2 (0.57) MAPK3ALKINSREGFRMET
SCHEMBL9911248 0.85 ALK (0.61) MAPK3ALKEGFRMETLRRK2
SCHEMBL1708506 0.85 EGFR (0.59) MAPK3ALKINSREGFRMET

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 978/4885ALK 2709/4885INSR 3571/4885

“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.