SCHEMBL14048137

SCHEMBL14048137

COc1ccc(S(=O)(=O)Nc2cccc(Cl)c2C)cc1S(=O)(=O)Nc1cccc(Cl)c1C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.57
▸ MAPK1 P28482 2/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ TSHR P16473 3/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ LMNA P02545 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ ALDH1A1 P00352 5/20 0.53
▸ MAPT P10636 1/20 0.52
▸ TP53 P04637 2/20 0.51
▸ NPSR1 Q6W5P4 2/20 0.51
▸ USP2 O75604 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ BRD4 O60885 1/20 0.51
▸ BRD2 P25440 1/20 0.51
▸ BRD3 Q15059 1/20 0.51
▸ CASP1 P29466 1/20 0.50
▸ CASP7 P55210 1/20 0.50

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
SCHEMBL14048147 0.93 KMT2A (0.55) KMT2AMAPK1MEN1TSHRNPC1
SCHEMBL14048146 0.86 KMT2A (0.56) KMT2AMAPK1MEN1TSHRLMNA
SCHEMBL29562518 0.84 MAPT (0.63) KMT2AMAPK1MEN1TSHRLMNA
SCHEMBL29562355 0.84 MAPT (0.63) KMT2AMAPK1MEN1TSHRLMNA
SCHEMBL22095975 0.81 PKM (0.61) KMT2AMAPK1MEN1TSHRNPC1
SCHEMBL29561286 0.80 MAPT (0.55) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL6187346 0.78 HTR6 (0.74) —
SCHEMBL22095984 0.78 LMNA (0.58) KMT2AMAPK1MEN1LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL6188378 0.78 HTR6 (0.73) —
SCHEMBL2176669 0.77 LMNA (0.61) KMT2AMEN1TSHRLMNASMN1; SMN2

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-2008129288-A2 DISULFONAMIDES USEFUL IN THE TREATMENT OF INFLAMMATION BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-10-30 — — WO disclosed
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