SCHEMBL8583418

SCHEMBL8583418

Cc1c(Cc2cccnc2)c2c(CCNS(=O)(=O)c3ccc(I)cc3)cccc2n1CCC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 19/20 0.57
TBXA2R P21731 6/20 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
SCHEMBL8541824 0.92 TBXAS1 (0.67) TBXAS1TBXA2R
SCHEMBL8608385 0.90 TBXAS1 (0.56) TBXAS1TBXA2R
SCHEMBL8538829 0.85 TBXAS1 (0.59) TBXAS1TBXA2R
SCHEMBL8537433 0.85 TBXAS1 (0.76) TBXAS1TBXA2R
SCHEMBL8543863 0.79 TBXAS1 (0.46) TBXAS1
SCHEMBL8582385 0.77 TBXAS1 (0.67) TBXAS1TBXA2R
SCHEMBL8538814 0.77 TBXAS1 (0.63) TBXAS1TBXA2R
SCHEMBL8542545 0.77 TBXAS1 (0.88) TBXAS1TBXA2R
SCHEMBL8541115 0.75 TBXAS1 (0.65) TBXAS1
SCHEMBL8538888 0.75 TBXAS1 (0.75) 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-5744488-A 1-CARBOXYALKYL-3-ALKYL OR PHENYL-5-ORGANOSULFONAMIDE OR -AMIDE INDOLES; ATHERSCLEROSIS; ANGINA; PREVENTING ANGIOPLASTY OCCULSION; THROMBOXANE SYNTHETASE INHIBITORS PFIZER INC. (US) 1998-04-28 US claimed