SCHEMBL16153102

SCHEMBL16153102

O=C(NCCO)c1ccc(-c2c3ccc(=O)cc-3oc3cc(O)ccc23)c(C(=O)O)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
CA9 Q16790 6/20 0.60
ALB P02768 1/20 0.57
FOLH1 Q04609 2/20 0.56
SLC5A2 P31639 2/20 0.55
MEN1 O00255 2/20 0.55
POLB P06746 2/20 0.55
KMT2A Q03164 2/20 0.55
ALPL P05186 1/20 0.55
ALPI P09923 1/20 0.55
ALPG P10696 1/20 0.55
CA1 P00915 4/20 0.53
CA2 P00918 4/20 0.53
CA12 O43570 3/20 0.53
CA14 Q9ULX7 2/20 0.53
CA7 P43166 1/20 0.53
ESR1 P03372 1/20 0.53
ATM Q13315 1/20 0.53
PLEC Q15149 1/20 0.53

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
SCHEMBL15298994 0.94 USP2 (0.58) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL12464671 0.92 USP2 (0.61) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL9906230 0.92 USP2 (0.66) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL23258882 0.92 USP2 (0.63) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL15143443 0.92 USP2 (0.63) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL15143488 0.91 USP2 (0.62) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL12464765 0.91 USP2 (0.62) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL15717108 0.90 USP2 (0.61) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL10153957 0.90 USP2 (0.66) USP2L3MBTL1CA9ALBFOLH1
SCHEMBL13287065 0.89 USP2 (0.60) USP2L3MBTL1CA9ALBFOLH1

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
EP-1782071-B1 COVALENT TETHERING OF FUNCTIONAL GROUPS TO PROTEINS AND SUBSTRATES THEREFOR PROMEGA CORP (US) 2014-10-08 EP disclosed