SCHEMBL4714650

SCHEMBL4714650

CCCCCCCCCCCCNS(=O)(=O)c1ccc(CNCc2cccc(C(F)(F)F)c2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
SCN8A Q9UQD0 1/20 0.41
TRPV1 Q8NER1 2/20 0.40
TRPV4 Q9HBA0 1/20 0.39
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP19A1 P11511 1/20 0.38
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.37
RAB9A P51151 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
GUSB P08236 1/20 0.37
IDH2 P48735 1/20 0.37

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
SCHEMBL4717989 1.00 MEN1 (0.47) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1852234 0.88 HTT (0.51) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL4714646 0.86 TSHR (0.47) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL4717987 0.86 TSHR (0.47) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL1856043 0.84 SMN1; SMN2 (0.56) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL4711910 0.84 MAPT (0.40) SCN8ATRPV1TRPV4POLBMAPT
SCHEMBL1854854 0.83 SMN1; SMN2 (0.42) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL4016045 0.83 SMN1; SMN2 (0.42) MEN1KMT2ATSHRHTTSMN1; SMN2
SCHEMBL5047441 0.82 BCHE (0.44) MEN1KMT2ATRPV1POLBMAPT
SCHEMBL5040032 0.81 ERBB2 (0.42) MEN1KMT2ATSHRHTTSMN1; SMN2

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