SCHEMBL2960055

SCHEMBL2960055

CC(C)n1nc(C(C)(C)C)cc1NC(=O)Nc1ccc(CN2CCN(C(=O)c3ccc(F)cc3F)CC2)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.43
MAPK14 Q16539 4/20 0.41
NTRK1 P04629 1/20 0.40
ALDH1A1 P00352 2/20 0.40
RAF1 P04049 2/20 0.39
BRAF P15056 2/20 0.39
NTRK3 Q16288 1/20 0.39
FLT3 P36888 3/20 0.38
GPR6 P46095 3/20 0.38
LMNA P02545 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL2960425 0.91 EPHX2 (0.48) EPHX2MAPK14FLT3LMNA
SCHEMBL4603694 0.81 MAPK14 (0.53) EPHX2MAPK14
SCHEMBL4602299 0.78 MAPK14 (0.47) MAPK14NTRK1RAF1BRAFNTRK3
SCHEMBL2948049 0.78 MAPK14 (0.49) MAPK14FLT3LMNA
SCHEMBL2951799 0.76 NTRK1 (0.42) MAPK14NTRK1ALDH1A1BRAFNTRK3
SCHEMBL4604121 0.75 MAPK14 (0.53) MAPK14LMNA
SCHEMBL2955221 0.73 MAPK14 (0.47) MAPK14ALDH1A1
SCHEMBL4602849 0.72 MAPK14 (0.52) MAPK14NTRK1NTRK3
SCHEMBL4615515 0.70 MAPK14 (0.50) MAPK14NTRK1NTRK3
SCHEMBL2950787 0.70 MAPK14 (0.56) MAPK14LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7767674-B2 Kinase inhibitors ELI LILLY AND COMPANY (US) 2010-08-03 US disclosed
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 EPHX2 2089/4885MAPK14 436/4885NTRK1 1258/4885

“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.