SCHEMBL10659433

SCHEMBL10659433

CCOC(=O)CCCCON=C(c1cccnc1)c1cccnc1

nearest known ligand 0.93

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 18/20 0.93
TBXA2R P21731 5/20 0.55
LMNA P02545 1/20 0.51

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
SCHEMBL9601354 0.95 TBXAS1 (0.85) TBXAS1TBXA2R
SCHEMBL9601366 0.95 TBXAS1 (0.85) TBXAS1TBXA2R
SCHEMBL9601416 0.89 TBXAS1 (0.74) TBXAS1TBXA2R
SCHEMBL9601423 0.89 TBXAS1 (0.74) TBXAS1TBXA2R
SCHEMBL9601393 0.88 TBXAS1 (0.74) TBXAS1TBXA2RLMNA
SCHEMBL9601397 0.88 TBXAS1 (0.74) TBXAS1TBXA2RLMNA
SCHEMBL9602465 0.84 TBXAS1 (0.69) TBXAS1TBXA2RLMNA
SCHEMBL9602469 0.84 TBXAS1 (0.69) TBXAS1TBXA2RLMNA
SCHEMBL9601778 0.84 TBXAS1 (0.70) TBXAS1TBXA2R
SCHEMBL9601773 0.84 TBXAS1 (0.70) TBXAS1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4746671-A THROMBOXANE SYNTHETASE INHIBITION JANSSEN PHARMACEUTICA N.V. (BE) 1988-05-24 US disclosed