SCHEMBL9530856

SCHEMBL9530856

CCCC/C=C(/c1ccccc1)c1cccnc1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 20/20 0.72
TBXA2R P21731 1/20 0.68

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
SCHEMBL9528067 1.00 TBXAS1 (0.72) TBXAS1TBXA2R
SCHEMBL9528079 1.00 TBXAS1 (0.72) TBXAS1TBXA2R
SCHEMBL10618177 0.95 TBXAS1 (0.74) TBXAS1TBXA2R
SCHEMBL10617175 0.95 TBXAS1 (0.74) TBXAS1TBXA2R
SCHEMBL10617172 0.95 TBXAS1 (0.74) TBXAS1TBXA2R
SCHEMBL14288486 0.91 TBXAS1 (0.68) TBXAS1TBXA2R
SCHEMBL6897257 0.85 SIGMAR1 (0.54) TBXAS1TBXA2R
SCHEMBL9825429 0.85 TBXAS1 (0.72) TBXAS1TBXA2R
SCHEMBL9826802 0.85 TBXAS1 (0.72) TBXAS1TBXA2R
SCHEMBL9825438 0.85 TBXAS1 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337640-B1 PROCESS FOR PRODUCING SUBSTITUTED VINYL PYRIDINES Takeda Chemical Industries, Ltd. (JP) 1993-08-11 EP disclosed
EP-0337640-A1 Process for producing substituted vinyl pyridines Takeda Chemical Industries, Ltd. (JP) 1989-10-18 EP disclosed