SCHEMBL30233262

SCHEMBL30233262

COC(=O)NCc1nc(N2CCC[C@H]2C)cc2c1CNC2=O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 17/20 0.40
LCP2 Q13094 1/20 0.38
RPS6KA2 Q15349 2/20 0.38
PRKD2 Q9BZL6 2/20 0.38
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36

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
SCHEMBL28975036 0.91 MAP4K1 (0.38) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL29261261 0.91 MAP4K1 (0.38) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL25099884 0.86 MAP4K1 (0.51) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL29261252 0.86 MAP4K1 (0.51) MAP4K1LCP2RPS6KA2PRKD2
SCHEMBL29261224 0.86 MAP4K1 (0.42) MAP4K1
SCHEMBL25100255 0.86 MAP4K1 (0.42) MAP4K1
SCHEMBL23987780 0.82 MAP4K1 (0.43) MAP4K1LCP2
SCHEMBL29261270 0.82 MAP4K1 (0.42) MAP4K1ADORA2AADORA1
SCHEMBL25100253 0.81 ADORA2A (0.38) MAP4K1ADORA2AADORA1
SCHEMBL29261274 0.81 ADORA2A (0.38) MAP4K1ADORA2AADORA1

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