SCHEMBL9420971

SCHEMBL9420971

O=C(O)c1cccc(NS(=O)(=O)c2ccccc2)c1NS(=O)(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 4/20 0.60
KMT2A Q03164 4/20 0.57
ALDH1A1 P00352 4/20 0.57
KDM4E B2RXH2 2/20 0.57
TSHR P16473 1/20 0.57
MEN1 O00255 3/20 0.57
GAA P10253 2/20 0.57
ACLY P53396 2/20 0.56
MCL1 Q07820 2/20 0.56
POLB P06746 1/20 0.55
HSD17B10 Q99714 1/20 0.53
LMNA P02545 1/20 0.53
RECQL P46063 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTT P42858 1/20 0.53
MMP2 P08253 1/20 0.52

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
SCHEMBL28930113 0.90 METAP2 (0.62) METAP2KMT2AALDH1A1KDM4ETSHR
SCHEMBL1466906 0.86 ALDH1A1 (0.72) METAP2KMT2AALDH1A1KDM4ETSHR
SCHEMBL5326630 0.84 ACLY (0.72) METAP2KMT2AALDH1A1TSHRMEN1
SCHEMBL28637555 0.84 KMT2A (0.58) METAP2KMT2AALDH1A1KDM4ETSHR
SCHEMBL13146414 0.81 ALDH1A1 (0.61) METAP2KMT2AALDH1A1KDM4ETSHR
SCHEMBL7570770 0.80 GAA (0.61) KMT2AALDH1A1MEN1GAAPOLB
SCHEMBL27396813 0.80 KMT2A (0.57) KMT2AALDH1A1KDM4ETSHRMEN1
SCHEMBL2201197 0.80 ELANE (0.64) METAP2KMT2AALDH1A1KDM4ETSHR
SCHEMBL1688339 0.79 METAP2 (0.71) METAP2KMT2AALDH1A1KDM4ETSHR
SCHEMBL6417385 0.79 MEN1 (0.72) METAP2KMT2AALDH1A1KDM4EMEN1

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-1994002543-A1 WATERBORNE EPOXY DERIVED ADHESIVE PRIMERS THE DEXTER CORPORATION (US) 1994-02-03 WO disclosed