SCHEMBL30728313

SCHEMBL30728313

CCCCC1(CC)CN(c2ccccc2)c2cc(SC)ccc2S(=O)(=O)C1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC10A2 Q12908 18/20 0.40
NR1H4 Q96RI1 1/20 0.34
ELANE P08246 1/20 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
SCHEMBL28917286 0.96 SLC10A2 (0.39) SLC10A2NR1H4
SCHEMBL29384612 0.92 SLC10A2 (0.34) SLC10A2
SCHEMBL6307088 0.87 SLC10A2 (0.46) SLC10A2NR1H4
SCHEMBL30728350 0.87 SLC10A2 (0.39) SLC10A2NR1H4
SCHEMBL27118502 0.86 NR1H4 (0.38) SLC10A2NR1H4ELANE
SCHEMBL8024294 0.86 SLC10A2 (0.42) SLC10A2ELANE
SCHEMBL8026044 0.85 SLC10A2 (0.48) SLC10A2
SCHEMBL22287261 0.84 NR1H4 (0.40) SLC10A2NR1H4
SCHEMBL22286780 0.84 NR1H4 (0.40) SLC10A2NR1H4
SCHEMBL3811339 0.84 NR1H4 (0.40) SLC10A2NR1H4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4551562-A1 BENZOTHIA(DI)AZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS Albireo AB (SE) 2025-05-14 EP disclosed
WO-2024008766-A1 BENZOTHIA(DI)AZEPINE COMPOUNDS AND THEIR USE AS BILE ACID MODULATORS ALBIREO AB (SE) 2024-01-11 WO disclosed