SCHEMBL2557596

SCHEMBL2557596

CC(=O)c1cccc(OC(F)(F)C(=O)O)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 11/20 0.51
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
CYP1A2 P05177 1/20 0.47
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MAOA P21397 3/20 0.44
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
KAT6A Q92794 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
SCHEMBL29742938 0.85 MAOB (0.55) MAOBKMT2AMEN1RAB9ANPC1
SCHEMBL697586 0.85 MAOB (0.55) MAOBKMT2AMEN1RAB9ANPC1
SCHEMBL23518951 0.84 NOTUM (0.59) KMT2AMEN1RAB9ANPC1ALDH1A1
SCHEMBL28079445 0.83 MAOB (0.54) MAOBKMT2AMEN1CYP1A2RAB9A
SCHEMBL2095019 0.82 MAOB (0.52) MAOBKMT2AMEN1CYP1A2RAB9A
SCHEMBL7927459 0.82 MAOB (0.52) MAOBKMT2AMEN1CYP1A2RAB9A
SCHEMBL5331403 0.82 MAOB (0.53) MAOBKMT2AMEN1CYP1A2RAB9A
SCHEMBL1619240 0.81 MAPT (0.52) MAOBKMT2AMEN1RAB9ANPC1
SCHEMBL26125657 0.80 LMNA (0.51) KMT2AMEN1CYP1A2RAB9AALDH1A1
SCHEMBL23519058 0.80 KAT6A (0.38) KAT6A

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 7 patents. 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
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed