SCHEMBL4747573

SCHEMBL4747573

O=S(=O)(Cl)c1cccc2ncsc12

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 16/20 0.41
CCKBR P32239 1/20 0.39
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.38
TRPV4 Q9HBA0 1/20 0.35
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM3 P20309 1/20 0.34
KCNH2 Q12809 1/20 0.34
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL1502479 0.84 CHRM1 (0.42) CHRM1CCKBRALDH1A1HSD17B10CHRM2
SCHEMBL29466721 0.81 CHRM1 (0.38) CHRM1CCKBRALDH1A1HSD17B10CHRM2
SCHEMBL6873638 0.78 CHRM1 (0.38) CHRM1CCKBRALDH1A1HSD17B10CHRM2
SCHEMBL23885006 0.76 CDK1 (0.31) TRPV4
SCHEMBL8415766 0.73 CHRM1 (0.37) CHRM1CCKBRALDH1A1HSD17B10CHRM2
Hydrochloric Acid SCHEMBL8414655 0.72 CHRM1 (0.36) CHRM1CCKBRALDH1A1HSD17B10CHRM2
SCHEMBL8417370 0.71 CYP3A4 (0.59) CHRM1CCKBRALDH1A1KCNH2
SCHEMBL3739722 0.71 ALDH1A1 (0.42) CCKBRALDH1A1HSD17B10
SCHEMBL17850498 0.71 ALDH1A1 (0.31) ALDH1A1HSD17B10
SCHEMBL928489 0.71 ALDH1A1 (0.45) CHRM1ALDH1A1HSD17B10TDP1

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
WO-2025104079-A1 SALICYLIC ACID AND PICOLINIC ACID DERIVATIVES AS INHIBITORS OF ENERGY COUPLING FACTOR (ECF) TRANSPORTERS FOR THE TREATMENT OF BACTERIAL INFECTIONS Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2025-05-22 WO disclosed
WO-2008124524-A2 ARYL SULFONAMIDE COMPOUNDS AS MODULATORS OF THE CCK2 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2008-10-16 WO disclosed