SCHEMBL4715548

SCHEMBL4715548

CCCCC(CC)CNS(=O)(=O)c1ccc(CC([NH])c2cccc(C(F)(F)F)c2)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.37
EPHX1 P07099 1/20 0.34
ELANE P08246 1/20 0.33
TP53 P04637 1/20 0.33
TRPV1 Q8NER1 1/20 0.33
ALDH1A1 P00352 6/20 0.33
KMT2A Q03164 3/20 0.32
TSHR P16473 2/20 0.32
HTT P42858 2/20 0.32
MEN1 O00255 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GLA P06280 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 2/20 0.32
MMP7 P09237 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 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
SCHEMBL4713475 0.87 MAPT (0.35) MAPTEPHX1ELANETP53TRPV1
SCHEMBL4716661 0.83 MAPT (0.37) MAPTEPHX1ELANETP53TRPV1
SCHEMBL4711910 0.81 MAPT (0.40) MAPTEPHX1ELANETRPV1POLB
SCHEMBL4711906 0.81 EPHX1 (0.38) MAPTEPHX1ELANETRPV1ALDH1A1
SCHEMBL5047436 0.80 MAPT (0.36) MAPTELANETP53ALDH1A1KMT2A
SCHEMBL4713478 0.79 NR1D1 (0.38) MAPTEPHX1TRPV1ALDH1A1KMT2A
SCHEMBL4022922 0.77 EPHX1 (0.39) MAPTEPHX1TRPV1ALDH1A1TSHR
SCHEMBL4714867 0.76 KMT2A (0.49) EPHX1TP53ALDH1A1KMT2ATSHR
SCHEMBL5040028 0.74 ACP3 (0.43) MAPTELANETP53ALDH1A1TSHR
SCHEMBL4711947 0.74 TSHR (0.41) MAPTTP53ALDH1A1KMT2ATSHR

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 claimed
WO-2007093557-A1 SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF BACTERIAL INFECTIONS LABORATOIRES SERONO S.A. (CH) 2007-08-23 WO claimed