SCHEMBL25819859

SCHEMBL25819859

CCC1(CNC)CCCC1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 14/20 0.36
SLC6A3 Q01959 13/20 0.34
SLC6A2 P23975 7/20 0.34

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
SCHEMBL22944895 0.97 SLC6A4 (0.39) SLC6A4SLC6A3SLC6A2
SCHEMBL18602892 0.95
SCHEMBL22641048 0.78 SLC6A4 (0.38) SLC6A4SLC6A3
SCHEMBL22944898 0.78 SLC6A4 (0.37) SLC6A4SLC6A3SLC6A2
SCHEMBL25556998 0.78
SCHEMBL16377420 0.77 SLC6A4 (0.35) SLC6A4SLC6A3SLC6A2
SCHEMBL258284 0.76
SCHEMBL5586373 0.75 CARM1 (0.30)
SCHEMBL17662686 0.75 SLC6A4 (0.31) SLC6A4SLC6A3
SCHEMBL19779413 0.75 SLC6A4 (0.38) SLC6A4SLC6A3SLC6A2

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-2023116934-A1 KRASG12D PROTEIN HYDROLYSIS REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 苏州泽璟生物制药股份有限公司 2023-06-29 WO disclosed