SCHEMBL6436200

SCHEMBL6436200

O=C(NCc1ccc(S(=O)(=O)N2CCN(c3cc(C(F)(F)F)ccn3)CC2)s1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
ALDH1A1 P00352 4/20 0.51
MAPT P10636 4/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPK9 P45984 1/20 0.45
MAPK10 P53779 1/20 0.45
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHRM4 P08173 2/20 0.43
DCTPP1 Q9H773 1/20 0.41
TSHR P16473 1/20 0.41
CCKBR P32239 1/20 0.41
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40

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
SCHEMBL2424204 0.92 MAPK9 (0.51) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL7448390 0.88 MAPK9 (0.48) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL7896117 0.86 ALDH1A1 (0.58) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL6436632 0.85 MEN1 (0.57) KMT2AMEN1MAPTMAPK9MAPK10
SCHEMBL3479771 0.80 L3MBTL1 (0.55) KMT2AMEN1MAPTKDM4EMAPK9
SCHEMBL2425741 0.79 MAPK9 (0.59) KMT2AMEN1ALDH1A1MAPTKDM4E
SCHEMBL2428656 0.78 MAPT (0.57) KMT2AMEN1ALDH1A1MAPTMAPK9
SCHEMBL6439162 0.77 MEN1 (0.58) KMT2AMEN1ALDH1A1MAPTMAPK9
SCHEMBL7435815 0.77 MAPK9 (0.55) KMT2AMEN1ALDH1A1MAPTMAPK9
SCHEMBL3480052 0.77 MAPK9 (0.51) KMT2AMEN1ALDH1A1MAPTKDM4E

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
EP-1218374-B1 PHARMACEUTICALLY ACTIVE SULFONAMIDE DERIVATIVES APPLIED RESEARCH SYSTEMS (AN) 2005-11-16 EP claimed