SCHEMBL4730135

SCHEMBL4730135

O=S1(=O)c2cc(F)ccc2C2(CCCCC2)c2ccc(S(=O)(=O)N(Cl)C3CCN(S(=O)(=O)c4ccccc4)CC3)cc21

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 3/20 0.37
GAA P10253 3/20 0.37
HTT P42858 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
POLB P06746 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
TSHR P16473 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35
CHRM1 P11229 2/20 0.35
DRD2 P14416 1/20 0.35
USP2 O75604 2/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL4801378 0.81 KDM4E (0.39) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4802225 0.66 KMT2A (0.41) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4795055 0.64 KMT2A (0.39) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL4734556 0.63 KCNK2 (0.41) ALDH1A1PTGDR2
SCHEMBL4798095 0.62 HTR2C (0.39) ALDH1A1HTTHTR2AHTR2CSMN1; SMN2
SCHEMBL5531315 0.61 ALDH1A1 (0.65) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL27658769 0.60 ALDH1A1 (0.51) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL2060095 0.58 PKM (0.62) PKMMEN1KMT2AALDH1A1KDM4E
SCHEMBL4705429 0.58 GAA (0.61) PKMMEN1KMT2AALDH1A1KDM4E
SCHEMBL4704361 0.58 GAA (0.61) PKMMEN1KMT2AALDH1A1KDM4E

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
WO-2008061029-A1 ARYL SULFONAMIDE DERIVATIVES AND METHODS OF THEIR USE WYETH (US) 2008-05-22 WO disclosed