SCHEMBL2560717

SCHEMBL2560717

Cc1ccc(OCc2ccc(B(O)O)cc2)cc1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 5/20 0.50
▸ NPC1 O15118 4/20 0.50
▸ HSP90AA1 P07900 1/20 0.50
▸ HRH3 Q9Y5N1 1/20 0.50
▸ GAA P10253 1/20 0.49
▸ HPGD P15428 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MAPT P10636 1/20 0.47
▸ ENPP2 Q13822 2/20 0.45
▸ LMNA P02545 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ LPL P06858 2/20 0.43
▸ LIPG Q9Y5X9 2/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ APEX1 P27695 1/20 0.43
▸ MAPK1 P28482 1/20 0.43

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
SCHEMBL2553220 0.90 ENPP2 (0.51) RAB9ANPC1HSP90AA1HRH3GAA
SCHEMBL16687439 0.88 MAOB (0.45) RAB9ANPC1HSP90AA1HRH3GAA
SCHEMBL177467 0.86 HRH3 (0.54) RAB9ANPC1HRH3GAAHPGD
SCHEMBL10269545 0.86 NPC1 (0.43) RAB9ANPC1HSP90AA1HRH3GAA
SCHEMBL12337966 0.86 RAB9A (0.57) RAB9ANPC1HSP90AA1HRH3GAA
SCHEMBL2558160 0.83 ENPP2 (0.61) RAB9ANPC1HSP90AA1SMN1; SMN2ENPP2
SCHEMBL12420267 0.82 APP (0.54) ENPP2LMNALPLLIPGCA1
SCHEMBL16687435 0.81 MAOB (0.58) RAB9ANPC1HRH3SMN1; SMN2MAPT
SCHEMBL2553625 0.81 MAOB (0.58) RAB9ANPC1HRH3SMN1; SMN2MAPT
SCHEMBL13401924 0.81 MAOB (0.59) RAB9ANPC1HSP90AA1HRH3GAA

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
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