SCHEMBL9681901

SCHEMBL9681901

CCOC(=O)CC(C)(C)Cc1nc2cc(F)ccc2n1Cc1ccc2ccccc2c1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 16/20 0.62
ALOX5AP P20292 4/20 0.50

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
SCHEMBL9681443 0.90 TBXA2R (0.61) TBXA2RALOX5AP
SCHEMBL9683117 0.89 TBXA2R (0.64) TBXA2RALOX5AP
SCHEMBL9682056 0.88 TBXA2R (0.80) TBXA2RALOX5AP
SCHEMBL9681858 0.88 TBXA2R (0.77) TBXA2R
SCHEMBL9682431 0.88 TBXA2R (0.77) TBXA2RALOX5AP
SCHEMBL9683030 0.88 TBXA2R (0.78) TBXA2RALOX5AP
SCHEMBL9681962 0.87 TBXA2R (0.78) TBXA2RALOX5AP
SCHEMBL9682478 0.86 TBXA2R (0.78) TBXA2R
SCHEMBL9683508 0.85 TBXA2R (0.62) TBXA2RALOX5AP
SCHEMBL9699144 0.80 TBXA2R (0.76) TBXA2RALOX5AP

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 claimed
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