SCHEMBL2557802

SCHEMBL2557802

CCc1ccccc1OCC=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.56
MAPT P10636 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
CTSS P25774 3/20 0.50
CTSK P43235 3/20 0.50
CTSL P07711 2/20 0.50
HPGD P15428 2/20 0.49
ATM Q13315 1/20 0.49
KDM4E B2RXH2 2/20 0.45
NISCH Q9Y2I1 1/20 0.44
TSHR P16473 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HTT P42858 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL9259701 0.82 ALDH1A1 (0.56) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL3946342 0.82 L3MBTL1 (0.53) L3MBTL1MAPTNPSR1CTSSCTSK
SCHEMBL3958742 0.81 THRA (0.56) CTSSCTSKCTSLTSHRADRB2
SCHEMBL5259389 0.81 L3MBTL1 (0.62) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL22650285 0.79 HPGD (0.56) L3MBTL1HPGDTSHRSMN1; SMN2
SCHEMBL28479323 0.79 L3MBTL1 (0.51) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL27721820 0.79 L3MBTL1 (0.56) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL10783529 0.79 L3MBTL1 (0.84) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL31054 0.79 L3MBTL1 (0.84) L3MBTL1MAPTNPSR1HPGDATM
SCHEMBL13820052 0.79 L3MBTL1 (0.64) L3MBTL1MAPTNPSR1HPGDATM

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2594626-A1 Use of oxyacetaldehyde as lily of the valley fragrance Symrise AG (DE) 2013-05-22 EP claimed
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
EP-2594626-B1 Use of oxyacetaldehyde as lily of the valley fragrance SYMRISE AG (DE) 2014-06-25 EP disclosed
EP-2594626-B1 Use of oxyacetaldehyde as lily of the valley fragrance SYMRISE AG (DE) 2014-06-25 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-2594626-A1 Use of oxyacetaldehyde as lily of the valley fragrance Symrise AG (DE) 2013-05-22 EP disclosed
EP-2594626-A1 Use of oxyacetaldehyde as lily of the valley fragrance Symrise AG (DE) 2013-05-22 EP 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