SCHEMBL25853377

SCHEMBL25853377

C=C1CN(C(=O)C(C)(C)O)CC/C1=C/CC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.32
▸ DPP8 Q6V1X1 1/20 0.32
▸ NAMPT P43490 1/20 0.31
▸ FASN P49327 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
SCHEMBL25849676 0.69 RIPK1 (0.32) RIPK1NAMPTFASN
SCHEMBL25848587 0.67 RIPK1 (0.35) RIPK1NAMPTFASN
SCHEMBL25848676 0.66 NAMPT (0.33) RIPK1NAMPTFASN
SCHEMBL25848673 0.61 NAMPT (0.43) RIPK1NAMPTFASN
SCHEMBL20012496 0.60 EPHX2 (0.41) DPP8NAMPTFASN
SCHEMBL17815833 0.59 DPP8 (0.36) RIPK1DPP8FASN
SCHEMBL12767514 0.59 HSD11B1 (0.49) FASN
SCHEMBL30920969 0.58 FASN (0.44) RIPK1NAMPTFASN
SCHEMBL8485188 0.58 FASN (0.44) FASN
SCHEMBL17282284 0.58 USP2 (0.47) —

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
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