SCHEMBL4603584

SCHEMBL4603584

COc1cccc(F)c1C(=O)N1CCC(Oc2cc(F)cc(NC(=O)Nc3cc(C(C)(C)C)nn3C)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 5/20 0.45
BRAF P15056 4/20 0.45
MAPK14 Q16539 11/20 0.43
CYP1A2 P05177 2/20 0.41
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
MAPK13 O15264 3/20 0.41
MAPK12 P53778 2/20 0.41
MAPK11 Q15759 2/20 0.41

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
SCHEMBL2957020 0.95 MAPK14 (0.47) RAF1MAPK14CYP1A2MAPTLMNA
SCHEMBL4603660 0.92 BRAF (0.51) RAF1BRAFMAPK14MAPTMAPK13
SCHEMBL2960293 0.91 LMNA (0.47) RAF1MAPK14CYP1A2MAPTLMNA
SCHEMBL2957789 0.89 LMNA (0.49) RAF1MAPK14CYP1A2MAPTLMNA
SCHEMBL2958673 0.88 MAPK14 (0.48) RAF1MAPK14CYP1A2MAPTLMNA
SCHEMBL4603544 0.87 MAPK14 (0.51) RAF1BRAFMAPK14MAPTLMNA
SCHEMBL4604505 0.86 BRAF (0.47) RAF1BRAFMAPK14MAPTLMNA
SCHEMBL2957568 0.86 MAPK14 (0.52) RAF1MAPK14CYP1A2MAPTLMNA
SCHEMBL4604675 0.86 MAPK14 (0.55) RAF1MAPK14MAPTMAPK13MAPK12
SCHEMBL2957016 0.85 MAPT (0.48) RAF1MAPK14CYP1A2MAPTLMNA

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-20080306068-A1 Suppression cytokines, tumor necrosis factor ELI LILLY AND COMPANY (US) 2008-12-11 US disclosed
EP-1761520-B1 KINASE INHIBITORS LILLY CO ELI (US) 2008-07-09 EP 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-20080306068-A1 Suppression cytokines, tumor necrosis factor TNF, TNFRSF1A, IL2 RAF1 249/4885BRAF 289/4885MAPK14 436/4885

“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.