SCHEMBL6398951

SCHEMBL6398951

O=C(CCN(c1cc(Cl)ccc1F)S(=O)(=O)c1ccc(Cl)cc1)NCc1cccs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 1/20 0.47
KMT2A Q03164 6/20 0.47
POLB P06746 4/20 0.47
GRK2 P25098 1/20 0.47
PTPN7 P35236 1/20 0.47
RECQL P46063 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
USP2 O75604 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
MEN1 O00255 4/20 0.45
ALDH1A1 P00352 2/20 0.45
PKM P14618 2/20 0.45
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44

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
SCHEMBL6398948 0.79 PSEN1 (0.48) CXCR3SMN1; SMN2KMT2ACYP3A4CYP2D6
SCHEMBL6399954 0.78 PSEN1 (0.51) PKMLMNA
SCHEMBL6395532 0.76 PSEN1 (0.51) PKM
SCHEMBL6393189 0.72 PSEN1 (0.46) CXCR3ALDH1A1NPC1RAB9A
SCHEMBL18883303 0.71 THRB (0.68) SMN1; SMN2MAPTHPGDKMT2AMEN1
SCHEMBL15228424 0.69 THRB (0.62) MAPTKMT2ATDP1USP2MEN1
SCHEMBL7536490 0.69 PSEN1 (0.51)
SCHEMBL12407402 0.68 ALDH1A1 (0.59) KMT2APOLBCYP3A4CYP2D6CYP2C19
SCHEMBL7421988 0.68 PSEN1 (0.56)
SCHEMBL7435735 0.66 PSEN1 (0.51)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6967196-B1 Sulfonamide compounds and uses thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2005-11-22 US disclosed