SCHEMBL24535767

SCHEMBL24535767

CCC1CCc2nnc(C)n21

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 10/20 0.33
POLB P06746 1/20 0.32
RPS6KA2 Q15349 5/20 0.32
PRKD2 Q9BZL6 5/20 0.32
LCP2 Q13094 1/20 0.31
GAA P10253 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL25100167 0.89 POLB (0.38) POLB
SCHEMBL22484671 0.77 DPP4 (0.33) MAP4K1RPS6KA2PRKD2LCP2
SCHEMBL22485042 0.77 DPP4 (0.33) MAP4K1RPS6KA2PRKD2LCP2
SCHEMBL21152439 0.74 MAP3K5 (0.36) POLB
SCHEMBL22484670 0.74 MAP3K5 (0.36) POLB
SCHEMBL21693807 0.69 MAP4K1 (0.51) MAP4K1RPS6KA2PRKD2LCP2
SCHEMBL21706101 0.69 MAP4K1 (0.51) MAP4K1RPS6KA2PRKD2LCP2
SCHEMBL22484754 0.67 POLB (0.41) POLB
SCHEMBL23118868 0.66
SCHEMBL23118842 0.63

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-2022132686-A1 FUSED BICYCLIC PYRAZOLE DERIVATIVES AND METHODS OF USE THEREOF FOR THE TREATMENT OF HERPESVIRUSES MERCK SHARP & DOHME CORP. (US) 2022-06-23 WO disclosed