SCHEMBL29978259

SCHEMBL29978259

Cc1cc(F)c(N)cc1-n1cnc(C2CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAP3K5 Q99683 20/20 0.53
MAP3K6 O95382 1/20 0.44

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
SCHEMBL28391289 1.00 MAP3K5 (0.53) MAP3K5MAP3K6
SCHEMBL18027905 0.87 MAP3K5 (0.55) MAP3K5MAP3K6
SCHEMBL17880574 0.84 MAP3K5 (0.53) MAP3K5MAP3K6
SCHEMBL22601537 0.82 MAP3K5 (0.51) MAP3K5MAP3K6
SCHEMBL22642547 0.82 MAP3K5 (0.51) MAP3K5MAP3K6
SCHEMBL22096504 0.82 MAP3K5 (0.53) MAP3K5MAP3K6
SCHEMBL20672236 0.81 MAP3K5 (0.64) MAP3K5MAP3K6
SCHEMBL30433867 0.81 MAP3K5 (0.53) MAP3K5MAP3K6
SCHEMBL15135934 0.81 MAP3K5 (0.50) MAP3K5MAP3K6
SCHEMBL20557293 0.81 MAP3K5 (0.53) MAP3K5MAP3K6

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
CN-115504986-B Apoptosis signal regulating kinase inhibitor and preparation method and application thereof 江苏豪森药业集团有限公司 2024-05-14 CN disclosed
CN-115504986-A Apoptosis signal regulating kinase inhibitor and preparation method and application thereof 江苏豪森药业集团有限公司 2022-12-23 CN disclosed
CN-111094250-B Apoptosis signal regulating kinase inhibitor and preparation method and application thereof 江苏豪森药业集团有限公司 2022-11-04 CN disclosed