SCHEMBL6986543

SCHEMBL6986543

C[C@@H](CCCCO)CNS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.52
ALDH1A1 P00352 3/20 0.52
MEN1 O00255 3/20 0.50
TSHR P16473 2/20 0.50
HTT P42858 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PSEN1 P49768 2/20 0.43
PSEN2 P49810 2/20 0.43
APH1B Q8WW43 2/20 0.43
NCSTN Q92542 2/20 0.43
APH1A Q96BI3 2/20 0.43
PSENEN Q9NZ42 2/20 0.43
MAPT P10636 3/20 0.43
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
BMP1 P13497 1/20 0.38

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
SCHEMBL6986868 0.87 KMT2A (0.50) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6988610 0.85 KMT2A (0.51) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6985272 0.85 KMT2A (0.52) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6988643 0.85 SMN1; SMN2 (0.49) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6984609 0.84 KMT2A (0.49) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6986603 0.81 KMT2A (0.52) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6991203 0.81 KMT2A (0.58) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6985763 0.81 KMT2A (0.48) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL8300238 0.79 KMT2A (0.55) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6989169 0.79 KMT2A (0.44) KMT2AALDH1A1MEN1TSHRHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP claimed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 WO claimed
EP-1341779-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION Wyeth (US) 2003-09-10 EP disclosed
WO-2002057252-A2 HETEROCYCLIC SULFONAMIDE INHIBITORS OF BETA AMYLOID PRODUCTION WYETH (US) 2002-07-25 WO disclosed