SCHEMBL5060934

SCHEMBL5060934

Cn1nc(C(C)(C)C)cc1NC(=O)Nc1cc(Oc2ccnc(-c3cc[nH]n3)n2)ccc1F

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 8/20 0.54
MAPK13 O15264 2/20 0.54
ABL1 P00519 1/20 0.53
BRAF P15056 10/20 0.51
RAF1 P04049 1/20 0.45

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
SCHEMBL3666970 0.94 MAPK14 (0.62) MAPK14MAPK13ABL1BRAF
SCHEMBL5134551 0.88 MAPK14 (0.53) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3668506 0.87 MAPK14 (0.61) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3634646 0.85 MAPK14 (0.51) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3660642 0.85 MAPK14 (0.53) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3664166 0.85 MAPK14 (0.53) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3812139 0.85 MAPK14 (0.55) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL5065363 0.83 MAPK14 (0.53) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3665968 0.82 MAPK14 (0.62) MAPK14MAPK13ABL1BRAFRAF1
SCHEMBL3808752 0.79 MAPK14 (0.60) MAPK14MAPK13ABL1BRAF

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-20080269254-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES DECIPHERA PHARMACEUTICALS, LLC (US) 2008-10-30 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-20080269254-A1 KINASE INHIBITORS USEFUL FOR THE TREATMENT OF MYLEOPROLIFIC DISEASES AND OTHER PROLIFERATIVE DISEASES KIT, BRAF, RET MAPK14 267/4885MAPK13 183/4885ABL1 26/4885

“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.