SCHEMBL25838184

SCHEMBL25838184

Cc1cc2c(c([C@@H]3CCCN3)c1)CN(C(=O)N1CCO[C@H](C(F)(F)F)C1)CC2

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.31
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 0.31
POLB P06746 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
SCHEMBL25838324 0.84 LMNA (0.40) POLB
SCHEMBL30491482 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL30491446 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL30491280 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL25303318 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL25297260 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL25297259 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL25299959 0.82 MAP3K12 (0.35) ALOX5APFEN1
SCHEMBL25838486 0.81 HSD17B10 (0.32)
SCHEMBL25838487 0.81 HSD17B10 (0.32)

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-2023131122-A1 FUSED RING-SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 劲方医药科技(上海)有限公司 2023-07-13 WO disclosed