SCHEMBL9869742

SCHEMBL9869742

COC(=O)C1=Cc2sc(C(SC)C(OC=S)n3ccnc3)cc2CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 2/20 0.36
KMT2A Q03164 1/20 0.32

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
SCHEMBL10772058 0.77 TBXAS1 (0.39) TBXAS1
SCHEMBL9836059 0.75 TBXAS1 (0.58) TBXAS1KMT2A
SCHEMBL9869737 0.69 TBXAS1 (0.46) TBXAS1
SCHEMBL9835233 0.68 TBXAS1 (0.43) TBXAS1
SCHEMBL9836779 0.67 TBXAS1 (0.76) TBXAS1
SCHEMBL9837315 0.66 TBXAS1 (0.46) TBXAS1
SCHEMBL9835838 0.66 KDM4E (0.35) TBXAS1KMT2A
SCHEMBL9835184 0.66 TBXAS1 (0.61) TBXAS1
SCHEMBL9835177 0.66 TBXAS1 (0.53) TBXAS1
SCHEMBL9837543 0.64 TSHR (0.40) KMT2A

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-5021444-A Anticoagulants SANKYO COMPANY LIMITED (JP) 1991-06-04 US disclosed