SCHEMBL9255293

SCHEMBL9255293

COC(=O)c1c(-c2ccccc2)ccc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2

nearest known ligand 0.56

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 10/20 0.56
HDAC8 Q9BY41 2/20 0.48
TBXAS1 P24557 6/20 0.45
APOB P04114 1/20 0.43
MTTP P55157 1/20 0.43
KAT6A Q92794 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
SCHEMBL9015411 0.90 TBXA2R (0.60) TBXA2RHDAC8TBXAS1APOBMTTP
SCHEMBL9253927 0.85 TBXA2R (0.65) TBXA2RHDAC8TBXAS1
SCHEMBL9249635 0.80 TBXA2R (0.75) TBXA2RHDAC8TBXAS1
SCHEMBL9248492 0.80 TBXA2R (0.55) TBXA2RHDAC8TBXAS1
SCHEMBL9015468 0.79 TBXA2R (0.70) TBXA2RHDAC8TBXAS1
SCHEMBL9251895 0.78 TBXA2R (0.51) TBXA2RHDAC8TBXAS1
SCHEMBL9015454 0.77 TBXA2R (0.60) TBXA2RHDAC8TBXAS1
SCHEMBL9251507 0.77 TBXA2R (0.65) TBXA2RHDAC8TBXAS1
SCHEMBL7776609 0.77 TBXA2R (0.59) TBXA2RHDAC8TBXAS1
SCHEMBL9247878 0.76 TBXA2R (0.58) TBXA2RHDAC8TBXAS1

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-5472979-A Antithrombotics ADIR ET COMPAGNIE (FR) 1995-12-05 US disclosed