SCHEMBL11274459

SCHEMBL11274459

CCOC(=O)[C@@H](C)CCCCCCn1ccnc1

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 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
SCHEMBL11274457 1.00 TBXAS1 (0.71) TBXAS1
SCHEMBL11303283 0.84 TBXAS1 (0.70) TBXAS1
SCHEMBL11274189 0.83 TBXAS1 (1.00) TBXAS1
SCHEMBL11274186 0.83 TBXAS1 (1.00) TBXAS1
Hydrochloric Acid SCHEMBL11279568 0.82 TBXAS1 (1.00) TBXAS1
Hydrochloric Acid SCHEMBL11279573 0.82 TBXAS1 (1.00) TBXAS1
SCHEMBL11295098 0.79 TBXAS1 (0.74) TBXAS1
SCHEMBL9716291 0.79 TBXAS1 (0.63) TBXAS1
SCHEMBL11572618 0.79 TBXAS1 (0.63) TBXAS1
SCHEMBL11278039 0.78 TBXAS1 (0.53) TBXAS1

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-4355170-A ANTIINFLAMMATORY, HYPERTENSIVE, ANTIASTHMATIC AGENTS, A THROMBOXANE SYNTHETASE INHIBITORS ONO PHARMACEUTICAL CO., LTD. (JP) 1982-10-19 US claimed
US-4355170-A ANTIINFLAMMATORY, HYPERTENSIVE, ANTIASTHMATIC AGENTS, A THROMBOXANE SYNTHETASE INHIBITORS ONO PHARMACEUTICAL CO., LTD. (JP) 1982-10-19 US disclosed
US-4256757-A ANTIINFLAMMATORY AND HYPOTENSIVE AGENTS; THROMBOSIS; ASTHMA; NERVOUS SYSTEM DISORDERS ONO PHARMACEUTICAL CO., LTD. 1981-03-17 US disclosed