SCHEMBL15835595

SCHEMBL15835595

CC1(O)CN(c2cnc(C(=O)Nc3csc(-c4nccn4C4CC4)n3)cc2-n2cnc(C3CC3)c2)C1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 20/20 0.82
AKT1 P31749 11/20 0.71

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
SCHEMBL19927922 0.92 MAP3K5 (0.83) MAP3K5AKT1
SCHEMBL19927925 0.92 MAP3K5 (0.82) MAP3K5AKT1
SCHEMBL19927923 0.92 MAP3K5 (0.83) MAP3K5AKT1
SCHEMBL15811894 0.90 MAP3K5 (1.00) MAP3K5AKT1
SCHEMBL15835592 0.89 MAP3K5 (0.82) MAP3K5AKT1
SCHEMBL19927939 0.89 MAP3K5 (0.83) MAP3K5AKT1
SCHEMBL19927932 0.89 MAP3K5 (0.83) MAP3K5AKT1
SCHEMBL19927936 0.89 MAP3K5 (0.75) MAP3K5AKT1
SCHEMBL19927934 0.89 MAP3K5 (0.82) MAP3K5AKT1
SCHEMBL19927929 0.89 MAP3K5 (0.82) MAP3K5AKT1

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-9051313-B2 Apoptosis signal-regulating kinase inhibitors GILDEAD SCIENCES, INC. (US) 2015-06-09 US disclosed
US-20140179663-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2014-06-26 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-20140179663-A1 APOPTOSIS SIGNAL-REGULATING KINASE INHIBITORS AIFM1, MAP3K1, DAPK1 MAP3K5 12/4885AKT1 368/4885

“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.