SCHEMBL16675940

SCHEMBL16675940

COCC(C)N/C(=N/C(=O)Cc1ccccc1)Nc1n[nH]c2c(F)cc(F)cc12

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APOL1 O14791 1/20 0.39
MAPK1 P28482 15/20 0.39
CDK2 P24941 3/20 0.38
CCNE1 P24864 1/20 0.38
GSK3B P49841 2/20 0.38
CDK1 P06493 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
SCHEMBL16675936 0.78 MAPK1 (0.41) MAPK1GSK3B
SCHEMBL16675916 0.77 CDK2 (0.48) MAPK1CDK2CCNE1GSK3B
SCHEMBL16682111 0.76 CDK2 (0.46) MAPK1CDK2CCNE1GSK3B
SCHEMBL16675956 0.72 MAPK1 (0.39) MAPK1CDK2CCNE1
SCHEMBL16675939 0.71 CDK2 (0.39) MAPK1CDK2GSK3BCDK1
SCHEMBL16752828 0.70 GSK3B (0.51) MAPK1GSK3B
SCHEMBL16752826 0.70 GSK3B (0.51) MAPK1GSK3B
SCHEMBL16675914 0.69 NPC1 (0.47) MAPK1CDK2CCNE1
SCHEMBL16682126 0.68 HPGD (0.42) MAPK1CDK2CCNE1
SCHEMBL16752820 0.67 MAP2K4 (0.44) MAPK1CDK2GSK3B

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-9580391-B2 Saturated acyl guanidine for inhibition of F1F0-ATPase LYCERA CORPORATION (US) 2017-02-28 US disclosed
US-9580391-B2 Saturated acyl guanidine for inhibition of F1F0-ATPase LYCERA CORPORATION (US) 2017-02-28 US disclosed
US-20150119439-A1 SATURATED ACYL GUANIDINE FOR INHIBITION OF F1F0-ATPASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2015-04-30 US disclosed
US-20150119439-A1 SATURATED ACYL GUANIDINE FOR INHIBITION OF F1F0-ATPASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2015-04-30 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-20150119439-A1 SATURATED ACYL GUANIDINE FOR INHIBITION OF F1F0-ATPASE ATP5F1A, ATP5F1D, ATP5F1C APOL1 3323/4885MAPK1 3291/4885CDK2 3048/4885

“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.