SCHEMBL8311549

SCHEMBL8311549

Cc1ccccc1S(=O)(=O)NC(=O)Cc1ccccc1COc1ccc2oc(-c3nc(C(C)(C)C)cs3)cc2c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 8/20 0.40
RAPGEF3 O95398 1/20 0.40
SLC26A4 O43511 1/20 0.37
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 1/20 0.36
ADAM17 P78536 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33

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
SCHEMBL8310504 0.90 PTGER4 (0.43) PTGER4RAPGEF3SLC26A4
SCHEMBL210686 0.85 PPARD (0.42) PTGER4SLC26A4PPARDPPARA
SCHEMBL29623656 0.85 PPARD (0.42) PTGER4SLC26A4PPARDPPARA
SCHEMBL8313568 0.84 CYSLTR2 (0.42) PTGER4RAPGEF3
Hydrochloric Acid SCHEMBL1224090 0.84 PPARD (0.41) PTGER4SLC26A4PPARDPPARA
SCHEMBL8310811 0.80 PTGER4 (0.42) PTGER4SLC26A4PPARDPPARA
SCHEMBL8314225 0.80 SLC26A4 (0.38) PTGER4SLC26A4PPARDPPARA
SCHEMBL8310775 0.80 MAOB (0.42) SLC26A4
SCHEMBL8316517 0.80 BCL2 (0.43) PTGER4SLC26A4
SCHEMBL8314208 0.79 F2RL3 (0.36) PTGER4SLC26A4

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-0528337-B1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1999-10-20 EP disclosed
EP-0528337-A1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-24 EP disclosed