SCHEMBL9681816

SCHEMBL9681816

CC(C)(CC(=O)O)Cc1nc2nc(Cl)ccc2n1Cc1ccc(Cl)cc1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 20/20 0.71

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
SCHEMBL9681387 0.89 TBXA2R (0.71) TBXA2R
SCHEMBL9683033 0.86 TBXA2R (0.54) TBXA2R
SCHEMBL9683089 0.86 TBXA2R (0.73) TBXA2R
SCHEMBL9683255 0.83 TBXA2R (1.00) TBXA2R
SCHEMBL9681794 0.81 TBXA2R (1.00) TBXA2R
SCHEMBL9683144 0.80 TBXA2R (0.82) TBXA2R
SCHEMBL9681374 0.80 TBXA2R (0.88) TBXA2R
SCHEMBL9681429 0.80 TBXA2R (1.00) TBXA2R
SCHEMBL9683330 0.78 TBXA2R (0.89) TBXA2R
SCHEMBL9682959 0.78 TBXA2R (1.00) TBXA2R

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
US-5128359-A Benzimidazole and azabenzimidazole derivatives which are thromboxane receptor antagonists, their methods of preparation LABORATOIRES UPSA (FR) 1992-07-07 US disclosed
US-5124336-A Cardiovascular disorders LABORATOIRES UPSA (FR) 1992-06-23 US disclosed
US-5021443-A Noval benzimidazole and azabenzimiazole derivatives which are thromboxane receptor antagonists, their methods of preparation and pharmaceutical compositions in which they are present LABORATOIRES UPSA (FR) 1991-06-04 US disclosed