SCHEMBL2558575

SCHEMBL2558575

C=C(Cl)COc1ccc2ccccc2c1C=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.59
RAB9A P51151 5/20 0.59
NPC1 O15118 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
TDP1 Q9NUW8 2/20 0.58
GAA P10253 1/20 0.58
ADRB2 P07550 1/20 0.56
ADRB1 P08588 1/20 0.56
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
ERN1 O75460 1/20 0.47
HPGD P15428 6/20 0.46
ALDH1A1 P00352 5/20 0.43
NPSR1 Q6W5P4 3/20 0.43
LMNA P02545 2/20 0.43
MITF O75030 1/20 0.43
HSP90AA1 P07900 1/20 0.43
PKM P14618 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
SCHEMBL2556219 0.86 RAB9A (0.59) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL2560912 0.82 L3MBTL1 (0.67) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL2560084 0.81 MAPT (0.61) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL4392247 0.80 MAPT (0.68) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL12290142 0.80 MAPT (0.71) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL2560822 0.78 L3MBTL1 (0.59) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL28765646 0.78 L3MBTL1 (0.71) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL30343666 0.78 HPGD (0.68) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL4266742 0.78 HPGD (0.68) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1
SCHEMBL1253291 0.77 L3MBTL1 (0.75) MAPTRAB9ANPC1SMN1; SMN2L3MBTL1

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