SCHEMBL4713478

SCHEMBL4713478

CCCCC(CC)CNS(=O)(=O)c1ccc(CN(CC)Cc2cccc(C(F)(F)F)c2)s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1D1 P20393 1/20 0.38
NR1H3 Q13133 1/20 0.38
EPHX1 P07099 2/20 0.36
MAPT P10636 5/20 0.36
POLB P06746 2/20 0.35
TRPV1 Q8NER1 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NR3C1 P04150 1/20 0.33
LMNA P02545 3/20 0.33
ALDH1A1 P00352 1/20 0.33
SIGMAR1 Q99720 1/20 0.32
ADRA2C P18825 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
DRD3 P35462 1/20 0.32
OPRK1 P41145 1/20 0.32
HTR2B P41595 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL4022922 0.88 EPHX1 (0.39) EPHX1MAPTTRPV1LMNAALDH1A1
SCHEMBL4711910 0.85 MAPT (0.40) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4711906 0.85 EPHX1 (0.38) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4716481 0.81 NR1D1 (0.38) NR1D1NR1H3MAPTMEN1KMT2A
SCHEMBL4716661 0.80 MAPT (0.37) EPHX1MAPTPOLBTRPV1KMT2A
SCHEMBL4715548 0.79 MAPT (0.37) EPHX1MAPTPOLBTRPV1MEN1
SCHEMBL4713475 0.77 MAPT (0.35) EPHX1MAPTPOLBTRPV1MEN1
SCHEMBL4021417 0.75 LIMK2 (0.39) MAPTPOLBMEN1KMT2ALMNA
SCHEMBL4016045 0.73 SMN1; SMN2 (0.42) EPHX1TRPV1MEN1KMT2ANR3C1
SCHEMBL1854854 0.73 SMN1; SMN2 (0.42) EPHX1TRPV1MEN1KMT2ANR3C1

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-1986637-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS Laboratoires Serono SA (CH) 2008-11-05 EP disclosed
WO-2007093557-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS LABORATOIRES SERONO S.A. (CH) 2007-08-23 WO disclosed