SCHEMBL6989207

SCHEMBL6989207

C[C@@H](CCC(O)c1ccc(N(C)C)cc1)CNS(=O)(=O)c1ccc(Cl)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.36
PSEN1 P49768 2/20 0.35
PSEN2 P49810 2/20 0.35
APH1B Q8WW43 2/20 0.35
NCSTN Q92542 2/20 0.35
APH1A Q96BI3 2/20 0.35
PSENEN Q9NZ42 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL6990063 0.89 KMT2A (0.43) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL6990380 0.85 KMT2A (0.40) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL6989394 0.82 CYP2D6 (0.43) KMT2AALDH1A1MEN1TSHRHTT
SCHEMBL6984609 0.81 KMT2A (0.49) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL6986868 0.77 KMT2A (0.50) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL5501851 0.77 LMNA (0.57) KMT2AALDH1A1MEN1SMN1; SMN2MAPT
SCHEMBL8300238 0.75 KMT2A (0.55) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL6986543 0.75 KMT2A (0.52) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL6989693 0.74 KMT2A (0.49) KMT2AALDH1A1MEN1SMN1; SMN2TSHR
SCHEMBL6985763 0.73 KMT2A (0.48) KMT2AALDH1A1MEN1SMN1; SMN2TSHR

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-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