SCHEMBL9745480

SCHEMBL9745480

O=C(O)C(C(=O)O)=C1SC=CS1.[BaH2]

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADRA1A P35348 1/20 0.45
PDE4D Q08499 1/20 0.45

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 SCHEMBL9745436 0.97 ADRA1A (0.43) ADRA1APDE4D
SCHEMBL9745261 0.94 ADRA1A (0.45) ADRA1APDE4D
SCHEMBL8385459 0.77 ADRA1A (0.50) ADRA1APDE4D
SCHEMBL9675143 0.76 ADRA1A (0.44) ADRA1APDE4D
SCHEMBL8055886 0.73 ADRA1A (0.82) ADRA1APDE4D
SCHEMBL9706743 0.71 PTPN1 (0.46)
SCHEMBL9745475 0.70 ADRA1A (0.43) ADRA1APDE4D
Water SCHEMBL9745425 0.69 ADRA1A (0.42) ADRA1APDE4D
SCHEMBL8531168 0.67 ADRA1A (0.61) ADRA1APDE4D
SCHEMBL11910041 0.67 ADRA1A (0.61) ADRA1APDE4D

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