SCHEMBL25845711

SCHEMBL25845711

C=CCCCCNCC1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SAT1 P21673 1/20 0.38
GNAI3 P08754 2/20 0.36
GNAO1 P09471 2/20 0.36
GNAI1 P63096 2/20 0.36
NAMPT P43490 1/20 0.32

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
SCHEMBL26027071 0.87 SAT1 (0.33) SAT1
SCHEMBL24293463 0.78 SAT1 (0.42) SAT1GNAI3GNAO1GNAI1
SCHEMBL21744423 0.76 MAPT (0.38) NAMPT
SCHEMBL15185846 0.75 FAAH (0.37) NAMPT
SCHEMBL16289244 0.75 FAAH (0.37) NAMPT
SCHEMBL25590629 0.75 GNAI3 (0.62) SAT1GNAI3GNAO1GNAI1
SCHEMBL19087023 0.75 GNAI3 (0.62) SAT1GNAI3GNAO1GNAI1
SCHEMBL16288892 0.74 FAAH (0.36) NAMPT
SCHEMBL15185847 0.74 FAAH (0.36) NAMPT
SCHEMBL2073702 0.74 TSHR (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