SCHEMBL17409792

SCHEMBL17409792

C=CC(=O)Nc1cc(OC)ccc1Nc1nc(Nc2ccc(N(CCN)C(C)=O)cc2OC)ncc1Cl

nearest known ligand 0.87

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 19/20 0.87
EGFR P00533 1/20 0.60

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
SCHEMBL17409767 0.96 MAPK3 (0.88) MAPK3EGFR
SCHEMBL15938466 0.93 MAPK3 (1.00) MAPK3EGFR
SCHEMBL15938345 0.92 MAPK3 (1.00) MAPK3EGFR
SCHEMBL15938170 0.89 MAPK3 (1.00) MAPK3EGFR
SCHEMBL15938343 0.85 MAPK3 (1.00) MAPK3EGFR
SCHEMBL15938730 0.84 MAPK3 (1.00) MAPK3EGFR
SCHEMBL15938831 0.84 MAPK3 (0.83) MAPK3EGFR
SCHEMBL15948597 0.83 MAPK3 (0.83) MAPK3EGFR
SCHEMBL17102721 0.83 MAPK3 (0.80) MAPK3EGFR
SCHEMBL15938541 0.83 MAPK3 (0.84) MAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9561228-B2 ERK inhibitors and uses thereof CELGENE AVILOMICS RESEARCH, INC. (US) 2017-02-07 US disclosed
US-20160002176-A1 ERK INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2016-01-07 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-20160002176-A1 ERK INHIBITORS AND USES THEREOF MAPK1, MAPK3, MAP4K2 MAPK3 2/4885EGFR 384/4885

“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.