SCHEMBL7997879

SCHEMBL7997879

O=C(NCc1ccc(S(=O)(=O)Nc2cccc(B(O)O)c2)s1)c1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK9 P45984 1/20 0.44
MAPK10 P53779 1/20 0.44
BCL2 P10415 1/20 0.43
BCL2L1 Q07817 1/20 0.43
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MEN1 O00255 5/20 0.42
KMT2A Q03164 5/20 0.42
MAPT P10636 4/20 0.42
HTT P42858 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
CCKBR P32239 1/20 0.42
POLB P06746 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
NAMPT P43490 1/20 0.39

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
SCHEMBL8013271 0.91 CCKBR (0.49) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL924672 0.75 MAPK9 (0.49) MAPK9MAPK10BCL2BCL2L1ALDH1A1
SCHEMBL13998433 0.74 MAPK9 (0.48) MAPK9MAPK10BCL2BCL2L1ALDH1A1
SCHEMBL6542892 0.73 HPGD (0.41) MAPK9MAPK10SMN1; SMN2KMT2A
SCHEMBL15161568 0.72 L3MBTL1 (0.41) MAPK9MAPK10BCL2BCL2L1ALDH1A1
SCHEMBL1518950 0.72 L3MBTL1 (0.47) BCL2BCL2L1ALDH1A1MEN1KMT2A
SCHEMBL12334071 0.72 RORA (0.47) ALDH1A1SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL12334602 0.71 CCKBR (0.52) BCL2BCL2L1ALDH1A1MEN1KMT2A
SCHEMBL16502984 0.71 LMNA (0.54) MAPK9MAPK10BCL2BCL2L1SMN1; SMN2
SCHEMBL3547639 0.71 BCL2 (0.45) MAPK9MAPK10BCL2BCL2L1SMN1; 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-2000035904-A1 INHIBITORS OF β-LACTAMASES AND USES THEREFOR NORTHWESTERN UNIVERSITY (US) 2000-06-22 WO disclosed