SCHEMBL9364368

SCHEMBL9364368

CC(NC(=O)c1ccccc1S(=O)(=O)Nc1ccc(F)cc1C(F)(F)F)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MCL1 Q07820 2/20 0.44
BCL2L1 Q07817 1/20 0.44
KCNA5 P22460 3/20 0.43
SLC22A12 Q96S37 2/20 0.40
KAT6A Q92794 1/20 0.39
IDH2 P48735 1/20 0.38
MRGPRX1 Q96LB2 1/20 0.38
CCKAR P32238 1/20 0.38
ACLY P53396 1/20 0.38
CTSS P25774 1/20 0.38
CTSK P43235 1/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.38
HSD17B10 Q99714 1/20 0.38
USP2 O75604 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
SCHEMBL9499823 0.89 TSHR (0.47) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9363849 0.89 MEN1 (0.45) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9363724 0.88 MEN1 (0.47) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9363879 0.86 MEN1 (0.46) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9363458 0.84 ALDH1A1 (0.63) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9500642 0.82 MEN1 (0.44) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9499692 0.82 TSHR (0.44) MEN1KMT2AALDH1A1MCL1BCL2L1
SCHEMBL9367198 0.82 SLC22A12 (0.60) MEN1KMT2AALDH1A1MCL1SLC22A12
SCHEMBL9363563 0.81 CA2 (0.50) MEN1KMT2AALDH1A1MCL1KCNA5
SCHEMBL9363397 0.81 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MCL1BCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0447013-B1 Fluorobenzene sulphonamides SCHERING AG (DE) 1994-08-03 EP disclosed
US-5210290-A NMR diagnostic aid SCHERING AKTIENGESELLSCHAFT (DE) 1993-05-11 US disclosed
EP-0447013-A1 Fluorobenzene sulphonamides SCHERING AKTIENGESELLSCHAFT (DE) 1991-09-18 EP disclosed