SCHEMBL9745475

SCHEMBL9745475

O=C([O-])C(C(=O)[O-])=C1SC=CS1.[Ba+2]

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.43
PDE4D Q08499 1/20 0.43

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
Water SCHEMBL9745425 0.97 ADRA1A (0.42) ADRA1APDE4D
Ammonia Solution, Strong SCHEMBL9559229 0.92 ADRA1A (0.42) ADRA1APDE4D
SCHEMBL2725876 0.72 ADRA1A (0.46) ADRA1APDE4D
SCHEMBL9665862 0.70 ADRA1A (0.50) ADRA1APDE4D
SCHEMBL9745480 0.70 ADRA1A (0.45) ADRA1APDE4D
Water SCHEMBL9745436 0.68 ADRA1A (0.43) ADRA1APDE4D
SCHEMBL9746136 0.68 KDM4E (0.35)
Water SCHEMBL9746700 0.67 KDM4E (0.34)
SCHEMBL10762156 0.66 ADRA1A (0.50) ADRA1APDE4D
Bicarbonate SCHEMBL9100985 0.57 CA4 (0.60)

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
US-5142075-A Anti-tumor platinum(II) complexes and process for the preparation thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1992-08-25 US disclosed