SCHEMBL25099366

SCHEMBL25099366

CNCc1nc(N(C)C(C)C)cc2c1CN(c1cccc(-c3nnc4n3C3CCC4C3)n1)C2=O

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 16/20 0.76
LCP2 Q13094 6/20 0.74
RPS6KA2 Q15349 1/20 0.72
PRKD2 Q9BZL6 1/20 0.72

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
SCHEMBL30232974 1.00 MAP4K1 (0.76) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL30233605 0.88 MAP4K1 (0.60) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL29261215 0.88 MAP4K1 (0.59) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL30136086 0.87 MAP4K1 (1.00) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL23988032 0.87 MAP4K1 (1.00) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL23988029 0.87 MAP4K1 (1.00) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL30136144 0.87 MAP4K1 (1.00) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL25100176 0.85 LCP2 (1.00) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL23988028 0.85 LCP2 (1.00) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL30136158 0.85 LCP2 (1.00) MAP4K1LCP2RPS6KA2PRKD2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023030478-A1 PYRIDOLACTAM DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF 浙江海正药业股份有限公司 2023-03-09 WO disclosed