SCHEMBL3427591

SCHEMBL3427591

O=C(CN(c1ccc(Cl)cc1)S(=O)(=O)c1cccc(F)c1)N1CCCC1c1ccccc1.O=C(CN(c1ccc(Cl)cc1)S(=O)(=O)c1ccccc1Cl)N1CCCC1c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 3/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RIPK1 Q13546 1/20 0.41
LMNA P02545 1/20 0.41
OXTR P30559 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
HCRTR2 O43614 2/20 0.40
TP53 P04637 1/20 0.40
HSD11B1 P28845 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
USP2 O75604 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38

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
SCHEMBL3424582 0.96 CRHBP (0.41) UTS2RPOLBHTTNPSR1RIPK1
SCHEMBL1629343 0.94 LMNA (0.44) UTS2RPOLBHTTNPSR1RIPK1
SCHEMBL1630544 0.91 HSD11B1 (0.47) UTS2RPOLBHTTNPSR1RIPK1
SCHEMBL3422260 0.90 CRHBP (0.41) UTS2RPOLBHTTNPSR1RIPK1
SCHEMBL1630647 0.89 CNR1 (0.43) UTS2RPOLBLMNACRHBPCRHR2
SCHEMBL1629153 0.89 HCRTR2 (0.44) POLBHTTNPSR1RIPK1LMNA
SCHEMBL1629076 0.87 LMNA (0.50) UTS2RPOLBHTTNPSR1LMNA
SCHEMBL1921417 0.86 DPP4 (0.37) UTS2RPOLBHTTNPSR1RIPK1
SCHEMBL1629105 0.85 HSD11B1 (0.45) UTS2RRIPK1LMNACRHBPCRHR2
SCHEMBL3422507 0.85 CRHBP (0.51) UTS2RPOLBHTTNPSR1LMNA

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-2245006-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. Hoffmann-La Roche AG (CH) 2010-11-03 EP disclosed
WO-2009092642-A1 SULFONAMIDES AS OREXIN ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2009-07-30 WO disclosed