SCHEMBL25197963

SCHEMBL25197963

CCCC(C)(C#N)SC(=S)SCCC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.38

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
SCHEMBL24982437 0.91 CYP1A2 (0.40) CYP1A2
SCHEMBL18586309 0.91 CYP1A2 (0.40) CYP1A2
SCHEMBL14246982 0.89 CYP1A2 (0.31) CYP1A2
SCHEMBL2231683 0.86 AKR1B1 (0.33)
SCHEMBL17618932 0.85
SCHEMBL23398348 0.84 GPR84 (0.37)
SCHEMBL23361291 0.84 GPR84 (0.37)
SCHEMBL19269475 0.84 GPR84 (0.37)
SCHEMBL851743 0.84 GPR84 (0.37)
SCHEMBL20141938 0.84 GPR84 (0.37)

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-2023090656-A1 METHOD FOR PREPARING POLYMER (주)경인양행 2023-05-25 WO disclosed