SCHEMBL25838280

SCHEMBL25838280

Cc1cc2c(c([C@@H]3CCCN3)c1)CCN(c1cnn(C)c1)C2

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.32
HSD17B10 Q99714 1/20 0.31

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
SCHEMBL25838282 0.92 HSD17B10 (0.31) HSD17B10
SCHEMBL25837978 0.80 HSD17B10 (0.33) HSD17B10
SCHEMBL25855874 0.80 PIK3CG (0.38)
SCHEMBL25838493 0.77 CHRNB2 (0.33) HSD17B10
SCHEMBL25837980 0.71 HSD17B10 (0.33) HSD17B10
SCHEMBL25838495 0.71 KCNH2 (0.33) HSD17B10
SCHEMBL25838310 0.70 MEN1 (0.35)
SCHEMBL25837977 0.69 NAMPT (0.33) HSD17B10
SCHEMBL25837961 0.69 PROKR1 (0.38)
SCHEMBL25837969 0.65 CHRM2 (0.40) HSD17B10

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