SCHEMBL9601562

SCHEMBL9601562

O=C(O)CCCCON=Cc1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.61
TBXAS1 P24557 9/20 0.58
FAAH O00519 9/20 0.48

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
SCHEMBL9601551 1.00 TAAR1 (0.61) TAAR1TBXAS1FAAH
SCHEMBL9601217 0.99 TAAR1 (0.60) TAAR1TBXAS1FAAH
SCHEMBL9601207 0.99 TAAR1 (0.60) TAAR1TBXAS1FAAH
SCHEMBL9602359 0.92 TAAR1 (0.64) TAAR1TBXAS1FAAH
SCHEMBL9602373 0.92 TAAR1 (0.64) TAAR1TBXAS1FAAH
SCHEMBL8305934 0.80 TAAR1 (0.67) TAAR1FAAH
SCHEMBL8305938 0.80 TAAR1 (0.67) TAAR1FAAH
SCHEMBL2635980 0.80 TBXAS1 (0.59) TBXAS1
SCHEMBL2635981 0.80 TBXAS1 (0.59) TBXAS1
SCHEMBL12186568 0.80 TBXAS1 (0.59) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0221601-B1 [[[(3-Pyridinyl)methylen]amino]oxy]alkanoic acids and esters JANSSEN PHARMACEUTICA N.V. (BE) 1993-03-10 EP disclosed
US-5180832-A Chemical intermediate for thromboxane A2 inhibitor JANSSEN PHARMACEUTICA N.V. (BE) 1993-01-19 US disclosed
US-4963573-A INHIBIT BIOSYNTHESIS OF THROMBOXANE A2 JANSSEN PHARMACEUTICA N.V. (BE) 1990-10-16 US disclosed
US-4746671-A THROMBOXANE SYNTHETASE INHIBITION JANSSEN PHARMACEUTICA N.V. (BE) 1988-05-24 US disclosed
EP-0221601-A1 [[[(3-Pyridinyl)methylen]amino]oxy]alkanoic acids and esters JANSSEN PHARMACEUTICA N.V. (BE) 1987-05-13 EP disclosed