SCHEMBL11287283

SCHEMBL11287283

Cc1c(C(=O)O)sc2ccc(Cn3ccnc3)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 19/20 1.00

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
SCHEMBL10955216 0.91 TBXAS1 (1.00) TBXAS1
SCHEMBL10953638 0.88 TBXAS1 (0.78) TBXAS1
SCHEMBL10953001 0.79 TBXAS1 (0.78) TBXAS1
SCHEMBL149467 0.77 TBXAS1 (1.00) TBXAS1
Hydrochloric Acid SCHEMBL10853833 0.76 TBXAS1 (0.98) TBXAS1
SCHEMBL9613211 0.76 TBXAS1 (0.60) TBXAS1
SCHEMBL10948748 0.76 TBXAS1 (0.60) TBXAS1
SCHEMBL9757026 0.74 TBXAS1 (0.58) TBXAS1
Oxalic Acid SCHEMBL11084954 0.72 TBXAS1 (0.58) TBXAS1
SCHEMBL6950423 0.72 TBXAS1 (0.56) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0050957-A1 Heterocyclic thromboxane synthetase inhibitors, processes for their preparation, and pharmaceutical compositions containing them Pfizer Limited (GB) 1982-05-05 EP disclosed