SCHEMBL17409790

SCHEMBL17409790

C=CC(=O)Nc1cc(OC)ccc1Nc1nc(Nc2ccc(N(CCNC(=O)OC(C)(C)C)C(C)=O)cc2C(F)(F)F)ncc1Cl

nearest known ligand 0.79

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 20/20 0.79

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
SCHEMBL17409791 0.96 MAPK3 (0.86) MAPK3
SCHEMBL15948505 0.92 MAPK3 (0.92) MAPK3
SCHEMBL15948515 0.89 MAPK3 (1.00) MAPK3
SCHEMBL15938730 0.88 MAPK3 (1.00) MAPK3
SCHEMBL15948501 0.86 MAPK3 (1.00) MAPK3
SCHEMBL15938436 0.83 MAPK3 (0.81) MAPK3
SCHEMBL17409774 0.83 MAPK3 (0.82) MAPK3
SCHEMBL15948506 0.83 MAPK3 (1.00) MAPK3
SCHEMBL17409792 0.81 MAPK3 (0.87) MAPK3
SCHEMBL18469346 0.81 MAPK3 (0.86) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2/4885

“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.