SCHEMBL29954313

SCHEMBL29954313

CC(=O)c1ccc(S(=O)(=O)N[C@@H](C)C(=O)O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 3/20 0.67
SLC1A3 P43003 1/20 0.64
SLC1A2 P43004 1/20 0.64
SLC1A1 P43005 1/20 0.64
MMP2 P08253 3/20 0.63
MMP3 P08254 3/20 0.63
MMP13 P45452 3/20 0.63
MMP1 P03956 2/20 0.63
MMP7 P09237 2/20 0.63
MMP9 P14780 2/20 0.63
CA12 O43570 1/20 0.55
CA9 Q16790 1/20 0.55
CA2 P00918 3/20 0.55
CA1 P00915 2/20 0.55
HPGD P15428 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MAPT P10636 1/20 0.50
ALDH1A1 P00352 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
SCHEMBL29957122 1.00 ADAMTS4 (0.67) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL12376738 0.84 SLC1A3 (0.60) ADAMTS4SLC1A3SLC1A2SLC1A1CA12
SCHEMBL4975578 0.83 ADAMTS4 (0.71) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL698907 0.83 ADAMTS4 (0.71) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL698908 0.83 ADAMTS4 (0.71) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL702794 0.82 ADAMTS4 (0.81) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL702793 0.82 ADAMTS4 (0.81) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL790069 0.82 ADAMTS4 (0.81) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL3951678 0.81 ADAMTS4 (0.69) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2
SCHEMBL3951681 0.81 ADAMTS4 (0.69) ADAMTS4SLC1A3SLC1A2SLC1A1MMP2

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-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed