SCHEMBL2558709

SCHEMBL2558709

Cc1ccc(OCc2ccccc2B(O)O)cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
MAPK1 P28482 1/20 0.48
ESR2 Q92731 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ATM Q13315 1/20 0.44
MAOB P27338 1/20 0.43
RAB9A P51151 8/20 0.43
NPC1 O15118 5/20 0.43
HSP90AA1 P07900 1/20 0.43
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
DRD3 P35462 1/20 0.42
HTR2A P28223 1/20 0.42
SLC6A4 P31645 1/20 0.42
GPR183 P32249 1/20 0.41
ACHE P22303 1/20 0.41

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
SCHEMBL2556977 0.87 MAPT (0.49) TP53POLBL3MBTL1MAOBRAB9A
SCHEMBL2561446 0.81 LIPG (0.41) TDP1L3MBTL1MAOBMAPTHPGD
SCHEMBL2556096 0.80 PARP10 (0.46) MAOBRAB9ANPC1HTR2ASLC6A4
SCHEMBL2557948 0.80 MRGPRX4 (0.45) POLBTDP1L3MBTL1ATMMAOB
SCHEMBL1260133 0.80 LIPG (0.50) MAOBSLC6A4RECQLALDH1A1SMN1; SMN2
SCHEMBL15332971 0.79 LIPG (0.46) POLBL3MBTL1ATMMAOBRAB9A
SCHEMBL13794698 0.79 TDP1 (0.51) ESR1TP53POLBAPEX1MAPK1
SCHEMBL2558583 0.78 LIPG (0.44) POLBMAOBHTR2ASLC6A4KMT2A
SCHEMBL2556560 0.78 MAOB (0.57) TP53MAPK1MAOBRAB9ANPC1
SCHEMBL21083437 0.78 MAOB (0.55) ESR1TP53POLBAPEX1MAPK1

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