SCHEMBL8473239

SCHEMBL8473239

CCCc1noc(NS(=O)(=O)c2ccccc2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 11/20 0.52
EDNRB P24530 9/20 0.52
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MT-CO2 P00403 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL8479988 0.90 EDNRA (0.55) EDNRAEDNRBTSHRMAPK1ALDH1A1
SCHEMBL8523604 0.84 EDNRA (0.51) EDNRAEDNRBTSHRMAPK1
SCHEMBL8477061 0.83 EDNRA (0.50) EDNRAEDNRBTSHRMAPK1
SCHEMBL8476607 0.82 EDNRA (0.53) EDNRAEDNRBTSHRMAPK1ALDH1A1
SCHEMBL8481520 0.81 EDNRA (0.50) EDNRAEDNRBTSHRMAPK1NPSR1
SCHEMBL8476543 0.81 TSHR (0.44) EDNRAEDNRBTSHRMAPK1ALDH1A1
SCHEMBL7221292 0.80 EDNRA (0.71) EDNRAEDNRBTSHR
SCHEMBL8478164 0.79 HSD11B1 (0.49) EDNRAEDNRBPTGS2
SCHEMBL8525137 0.76 EDNRA (0.55) EDNRAEDNRBTSHRMAPK1MT-CO2
SCHEMBL7850015 0.76 EDNRA (0.69) EDNRAEDNRBTSHR

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-5859257-A ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1999-01-12 US disclosed