SCHEMBL8799145

SCHEMBL8799145

COC(=O)C1=C(O)c2cc3c(c(CC4=COCO4)c2S(=O)(=O)N1)OCO3

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 1/20 0.31

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
SCHEMBL7336011 0.84 SMN1; SMN2 (0.41)
SCHEMBL8797162 0.74 EDNRB (0.34)
SCHEMBL7337339 0.72 NPC1 (0.36)
SCHEMBL7342903 0.69 SMN1; SMN2 (0.35)
SCHEMBL7068384 0.61 EDNRB (0.42)
SCHEMBL11502754 0.58 PTGES (0.33)
SCHEMBL7342661 0.57 PTGES (0.56)
SCHEMBL11493406 0.57 PTGES (0.47)
SCHEMBL12553124 0.57 ALDH1A1 (0.42) TARBP2
SCHEMBL11851145 0.57 MAPT (0.39)

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
EP-0811001-A1 BENZOTHIAZINE DIOXIDES AS ENDOTHELIN ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1997-12-10 EP disclosed