SCHEMBL9837280

SCHEMBL9837280

COC(=O)C=C1CCc2sc(CC(=O)n3ccnc3)cc2C1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 8/20 0.36
POLB P06746 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 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
SCHEMBL9836741 0.84 TBXAS1 (0.53) TBXAS1POLBALDH1A1GAA
SCHEMBL9834134 0.77 POLB (0.34) POLBALDH1A1
SCHEMBL9835464 0.77 TBXAS1 (0.53) TBXAS1POLBALDH1A1GAA
SCHEMBL9835694 0.71 ALDH1A1 (0.32) POLBALDH1A1
SCHEMBL10772896 0.65 HTT (0.34) POLBALDH1A1
SCHEMBL9837254 0.63 KMT2A (0.38) ALDH1A1
SCHEMBL9837100 0.63 TBXAS1 (0.60) TBXAS1ALDH1A1GAA
SCHEMBL9835048 0.62 ALDH1A1 (0.32) POLBALDH1A1
SCHEMBL28270134 0.60 TSHR (0.45) ALDH1A1
SCHEMBL9835073 0.58 KMT2A (0.38) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240107-B1 THIANAPHTHENE DERIVATIVES, THEIR PRODUCTION AND USE Sankyo Company Limited (JP) 1991-08-21 EP disclosed
US-4847272-A ANTICOAGULANTS SANKYO COMPANY LIMITED (JP) 1989-07-11 US disclosed
EP-0240107-A1 Thianaphthene derivatives, their production and use Sankyo Company Limited (JP) 1987-10-07 EP disclosed