SCHEMBL30233239

SCHEMBL30233239

CNC(=O)OCc1nc(N(C)C(C)C)cc2c1CN(c1cccc(-c3nnc4n3[C@@H]([C@@H](C)F)CC4)n1)C2=O

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ LCP2 Q13094 4/20 0.65
▸ MAP4K1 Q92918 15/20 0.65
▸ RPS6KA2 Q15349 3/20 0.64
▸ PRKD2 Q9BZL6 3/20 0.64

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
SCHEMBL30233316 0.91 LCP2 (0.78) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30233271 0.91 MAP4K1 (0.79) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30233031 0.91 MAP4K1 (0.79) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30232814 0.90 MAP4K1 (0.70) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30233136 0.89 MAP4K1 (0.69) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30233186 0.89 MAP4K1 (0.69) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30233266 0.89 LCP2 (0.72) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL25100202 0.88 LCP2 (0.82) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL30233017 0.88 LCP2 (0.82) LCP2MAP4K1RPS6KA2PRKD2
SCHEMBL29261260 0.88 LCP2 (0.82) LCP2MAP4K1RPS6KA2PRKD2

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
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