SCHEMBL2957016

SCHEMBL2957016

Cn1nc(C(C)(C)C)cc1NC(=O)Nc1cc(F)cc(OC2CCN(C(=O)c3c(Cl)cncc3Cl)CC2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
LMNA P02545 2/20 0.48
MAPK14 Q16539 14/20 0.45
MAPK13 O15264 2/20 0.45
MAPK11 Q15759 2/20 0.45
MAPK12 P53778 1/20 0.45
CYP1A2 P05177 2/20 0.43
RAF1 P04049 1/20 0.43
NTRK1 P04629 1/20 0.41
RET P07949 1/20 0.41
EPHB2 P29323 1/20 0.41
KDR P35968 1/20 0.41
ERBB2 P04626 1/20 0.40

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
SCHEMBL2957789 0.93 LMNA (0.49) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2960293 0.89 LMNA (0.47) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL4601552 0.89 MAPK14 (0.55) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2957020 0.88 MAPK14 (0.47) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL4603086 0.88 NTRK1 (0.49) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2959949 0.88 MAPK14 (0.47) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2960044 0.87 MAPT (0.46) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2953737 0.86 MAPT (0.49) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2955752 0.86 MAPK14 (0.48) MAPTLMNAMAPK14MAPK13MAPK11
SCHEMBL2958116 0.86 MAPK14 (0.50) MAPTLMNAMAPK14MAPK13MAPK11

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 MAPT 4665/4885LMNA 4573/4885MAPK14 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.