SCHEMBL11068352

SCHEMBL11068352

CC(Cc1ccc(Cc2cccnc2)cc1)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 17/20 1.00
LMNA P02545 1/20 0.58
KDM4E B2RXH2 1/20 0.50
NAPRT Q6XQN6 1/20 0.49

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
Hydrochloric Acid SCHEMBL11063078 0.99 TBXAS1 (1.00) TBXAS1LMNAKDM4ENAPRT
SCHEMBL15947894 0.89 TBXAS1 (0.80) TBXAS1LMNAKDM4ENAPRT
SCHEMBL266473 0.89 TBXAS1 (0.80) TBXAS1LMNAKDM4ENAPRT
SCHEMBL14732861 0.89 TBXAS1 (0.80) TBXAS1LMNAKDM4ENAPRT
SCHEMBL11059401 0.83 TBXAS1 (0.71) TBXAS1LMNA
SCHEMBL11062758 0.83 TBXAS1 (0.71) TBXAS1KDM4E
SCHEMBL11063965 0.82 TBXAS1 (0.70) TBXAS1LMNAKDM4ENAPRT
SCHEMBL11062271 0.82 TBXAS1 (0.70) TBXAS1LMNAKDM4ENAPRT
SCHEMBL11095704 0.80 TBXAS1 (0.67) TBXAS1LMNA
SCHEMBL11064081 0.80 TBXAS1 (0.67) TBXAS1LMNAKDM4ENAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4271170-A THROMBOXANE SYNTHETASE ENZYME INHIBITOR USEFUL IN TREATING INFLAMMATION, HYPERTENSION, THROMBUS, CEREBRAL APOPLEXY, ASTHMA, AND CARDIOVASCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD., (JP) 1981-06-02 US claimed
US-4427682-A ANTICOAGULANTS, ANTIINFLAMMATORY, HYPOTENSIVE, OR ANTIALLERGEN AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1984-01-24 US disclosed
US-4317828-A ANTIINFLAMMATORY AGENTS, HYPOTENSIVE AGENTS ONO PHARMACEUTICAL CO., LTD. (JP) 1982-03-02 US disclosed
US-4271170-A THROMBOXANE SYNTHETASE ENZYME INHIBITOR USEFUL IN TREATING INFLAMMATION, HYPERTENSION, THROMBUS, CEREBRAL APOPLEXY, ASTHMA, AND CARDIOVASCULAR DISORDERS ONO PHARMACEUTICAL CO., LTD., (JP) 1981-06-02 US disclosed