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Sugi Predict / Compounds / SCHEMBL16660402

SCHEMBL16660402

SCHEMBL16660402

C[C@@H](CO)Nc1ncc2c(n1)CN(C(=O)NCc1ccc(Cl)c(Cl)c1)CC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 20/20 1.00
▸ CDK2 P24941 2/20 0.74

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
SCHEMBL17081571 0.94 MAPK1 (0.89) MAPK1CDK2
SCHEMBL17081608 0.93 MAPK1 (0.87) MAPK1CDK2
SCHEMBL17081711 0.93 MAPK1 (0.86) MAPK1CDK2
SCHEMBL17081364 0.92 MAPK1 (0.85) MAPK1CDK2
SCHEMBL17081800 0.91 MAPK1 (0.83) MAPK1CDK2
SCHEMBL17081564 0.91 MAPK1 (0.83) MAPK1CDK2
SCHEMBL17081576 0.91 MAPK1 (0.83) MAPK1CDK2
SCHEMBL17081572 0.91 MAPK1 (0.83) MAPK1CDK2
SCHEMBL17081798 0.89 MAPK1 (0.80) MAPK1CDK2
SCHEMBL17081796 0.89 MAPK1 (0.80) MAPK1CDK2

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-9133187-B2 Serine/threonine kinase inhibitors ARRAY BIOPHARMA INC. (US) 2015-09-15 — — US disclosed
EP-2681215-B1 SERINE/THREONINE KINASE INHIBITORS ARRAY BIOPHARMA INC (US) 2015-04-22 — — EP disclosed