SCHEMBL7812420

SCHEMBL7812420

Cc1ccc(-c2c(NS(=O)(=O)c3ccc(C(C)(C)C)cc3)nc(NCCO)nc2OCCOCc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 8/20 0.57
EDNRB P24530 5/20 0.49
ABCC3 O15438 1/20 0.42
ABCC4 O15439 1/20 0.42
NR1I2 O75469 1/20 0.42
ABCB11 O95342 1/20 0.42
DHPS P49366 1/20 0.42
NR1H3 Q13133 1/20 0.42
NR1I3 Q14994 1/20 0.42

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
SCHEMBL7812128 0.85 EDNRA (0.55) EDNRAEDNRB
SCHEMBL7815181 0.85 EDNRA (0.44) EDNRAEDNRB
SCHEMBL7805397 0.84 EDNRA (0.54) EDNRAEDNRB
SCHEMBL7814428 0.84 EDNRB (0.70) EDNRAEDNRB
SCHEMBL8656735 0.80 EDNRA (0.70) EDNRAEDNRBABCC3ABCC4NR1I2
SCHEMBL7805440 0.77 EDNRA (0.57) EDNRAEDNRB
SCHEMBL9492466 0.76 EDNRA (0.70) EDNRAEDNRBABCC3ABCC4NR1I2
SCHEMBL8659228 0.75 EDNRA (0.72) EDNRAEDNRB
SCHEMBL8657656 0.75 EDNRA (0.72) EDNRAEDNRB
SCHEMBL8655641 0.75 EDNRA (0.71) EDNRAEDNRB

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-0743307-B1 Sulfonamide derivative and process for preparing the same TANABE SEIYAKU CO (JP) 2001-09-12 EP disclosed
EP-0743307-A1 Sulfonamide derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1996-11-20 EP disclosed