SCHEMBL16705174

SCHEMBL16705174

CNC(=O)Nc1cc(S(=O)(=O)O)cc(S(=O)(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.51
MAPT P10636 2/20 0.49
TIMP3 P35625 2/20 0.46
PRMT1 Q99873 1/20 0.45
ALDH1A1 P00352 3/20 0.44
ACP1 P24666 1/20 0.41
PIP4K2A P48426 1/20 0.40
PIP4K2B P78356 1/20 0.40
POLB P06746 1/20 0.40
FBP1 P09467 1/20 0.40
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CASR P41180 1/20 0.38
BDKRB1 P46663 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
SCHEMBL10895280 0.88 TIMP3 (0.56) KMT2AMAPTTIMP3PRMT1ALDH1A1
SCHEMBL16705173 0.81 KMT2A (0.71) KMT2ATIMP3ALDH1A1POLBCA12
SCHEMBL12110006 0.77 ALDH1A1 (0.45) TIMP3PRMT1ALDH1A1RECQLSMN1; SMN2
SCHEMBL16328857 0.74 TAS2R38 (0.42) MAPTTIMP3PRMT1ALDH1A1SMN1; SMN2
SCHEMBL16705175 0.73 ENPP2 (0.54) KMT2AMAPTPRMT1ALDH1A1PIP4K2A
SCHEMBL10872341 0.72 TGM2 (0.53)
SCHEMBL12049667 0.72 KMT2A (0.56) KMT2AMAPTALDH1A1POLBSMN1; SMN2
SCHEMBL8736327 0.71 ALDH1A1 (0.43) TIMP3PRMT1ALDH1A1RECQLSMN1; SMN2
SCHEMBL8733495 0.71 ALDH1A1 (0.43) TIMP3PRMT1ALDH1A1RECQLSMN1; SMN2
SCHEMBL15695581 0.71 MEN1 (0.60) KMT2AMAPTALDH1A1POLBCA12

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
US-9029492-B2 Superconducting electrolytic hybrid material, and preparation method and uses thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-05-12 US disclosed