SCHEMBL4789547

SCHEMBL4789547

Cn1c(Nc2ccc(Br)cc2Cl)c(C(=O)NOCC(O)CO)c2c1C(=O)CCC2

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 20/20 0.82
MAP2K2 P36507 1/20 0.42

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
SCHEMBL4789546 1.00 MAP2K1 (0.82) MAP2K1MAP2K2
SCHEMBL4789695 1.00 MAP2K1 (0.82) MAP2K1MAP2K2
SCHEMBL4789526 0.90 MAP2K1 (1.00) MAP2K1
SCHEMBL4789157 0.90 MAP2K1 (1.00) MAP2K1
SCHEMBL4789161 0.90 MAP2K1 (1.00) MAP2K1
SCHEMBL5063523 0.89 MAP2K1 (0.81) MAP2K1MAP2K2
SCHEMBL4789815 0.88 MAP2K1 (0.64) MAP2K1MAP2K2
SCHEMBL4789158 0.85 MAP2K1 (0.91) MAP2K1
SCHEMBL4789154 0.85 MAP2K1 (0.91) MAP2K1
SCHEMBL5058419 0.82 MAP2K1 (1.00) MAP2K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312307-A1 MAPK/ERK KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 US claimed
WO-2008148034-A1 MAPK/ERK KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-04 WO claimed
US-20080312307-A1 MAPK/ERK KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-18 US disclosed
WO-2008148034-A1 MAPK/ERK KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-04 WO 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-20080312307-A1 MAPK/ERK KINASE INHIBITORS MAPK1, MAP3K1, MAP3K7 MAP2K1 45/4885MAP2K2 41/4885

“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.