SCHEMBL29528596

SCHEMBL29528596

COC(=O)c1cc(Br)cc(C(=O)c2cc(F)cc(Br)c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.55
LMNA P02545 3/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 5/20 0.45
MAPT P10636 3/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
POLB P06746 3/20 0.42
GAA P10253 1/20 0.42
NFKB1 P19838 1/20 0.42
XDH P47989 1/20 0.42
GFER P55789 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42

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
SCHEMBL22400441 1.00 NOTUM (0.55) NOTUMLMNAMEN1KMT2AKDM4E
SCHEMBL2825430 0.93 NOTUM (0.62) NOTUMLMNAMEN1KMT2AKDM4E
SCHEMBL29453088 0.93 NOTUM (0.62) NOTUMLMNAMEN1KMT2AKDM4E
SCHEMBL184614 0.84 NOTUM (0.67) NOTUMLMNAMEN1KMT2AKDM4E
SCHEMBL1401499 0.84 CA1 (0.58) NOTUMLMNAMEN1KMT2AKDM4E
SCHEMBL26334404 0.81 NOTUM (0.53) NOTUMLMNAKDM4EMAPTCA12
SCHEMBL521670 0.80 CA1 (0.58) NOTUMLMNAMEN1KMT2AKDM4E
Methyl 3,5-Dibromobenzoate SCHEMBL2408987 0.80 NOTUM (0.67) NOTUMLMNAKDM4EMAPTCA12
SCHEMBL22400351 0.80 NOTUM (0.88) NOTUMLMNAKDM4EMAPTCA12
SCHEMBL22400347 0.80 NOTUM (0.51) NOTUMLMNAMEN1KMT2AKDM4E

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-3946363-A2 GLUCOSE SENSITIVE INSULIN DERIVATIVES Novo Nordisk A/S (DK) 2022-02-09 EP disclosed