SCHEMBL4711906

SCHEMBL4711906

CCCCC(CC)CNS(=O)(=O)c1ccc(C[N]Cc2cccc(C(F)(F)F)c2)s1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.38
MAPT P10636 4/20 0.37
POLB P06746 2/20 0.36
TRPV1 Q8NER1 2/20 0.35
LMNA P02545 2/20 0.33
SIGMAR1 Q99720 1/20 0.33
ADRA2C P18825 1/20 0.33
HTR2A P28223 1/20 0.33
SLC6A4 P31645 1/20 0.33
ADRA1A P35348 1/20 0.33
DRD3 P35462 1/20 0.33
OPRK1 P41145 1/20 0.33
HTR2B P41595 1/20 0.33
PPARG P37231 1/20 0.33
MIF P14174 1/20 0.33
MMP7 P09237 1/20 0.32
ELANE P08246 1/20 0.32
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL4711910 0.88 MAPT (0.40) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4718006 0.87 KMT2A (0.39) MAPTPOLBLMNAPPARGALDH1A1
SCHEMBL4713478 0.85 NR1D1 (0.38) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4717987 0.84 TSHR (0.47) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4714646 0.84 TSHR (0.47) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4022922 0.83 EPHX1 (0.39) EPHX1MAPTTRPV1LMNAPPARG
SCHEMBL4716661 0.82 MAPT (0.37) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4715548 0.81 MAPT (0.37) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4713475 0.81 MAPT (0.35) EPHX1MAPTPOLBTRPV1LMNA
SCHEMBL4025655 0.77 TSHR (0.40) MAPTLMNAPPARGALDH1A1NPSR1

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