SCHEMBL2558484

SCHEMBL2558484

O=Cc1ccc(OCC(=O)NCc2ccco2)cc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.68
ALDH1A1 P00352 10/20 0.65
MAPT P10636 5/20 0.65
HPGD P15428 5/20 0.65
NPSR1 Q6W5P4 1/20 0.65
PKM P14618 1/20 0.64
POLB P06746 5/20 0.59
L3MBTL1 Q9Y468 3/20 0.58
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
ALOX15 P16050 1/20 0.58
KDM4E B2RXH2 3/20 0.57
TSHR P16473 2/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
USP2 O75604 1/20 0.57
HTT P42858 1/20 0.57
ESR1 P03372 1/20 0.56
APEX1 P27695 1/20 0.56
TDP1 Q9NUW8 1/20 0.56

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
SCHEMBL12861415 0.85 ALDH1A1 (0.73) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL9266409 0.83 ALDH1A1 (0.71) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL2563006 0.80 ALDH1A1 (0.71) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL15332860 0.78 HPGD (0.65) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL2562836 0.77 ALDH1A1 (0.67) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL4672305 0.77 TDP1 (0.69) ALDH1A1MAPTHPGDPKMPOLB
SCHEMBL1300220 0.76 GAA (0.63) ALDH1A1MAPTHPGDL3MBTL1KMT2A
SCHEMBL4639642 0.76 HPGD (0.69) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL14829020 0.76 HIF1A (0.72) MAPK1ALDH1A1MAPTHPGDNPSR1
SCHEMBL6538870 0.75 RAB9A (0.63) ALDH1A1MAPTHPGDKDM4ESMN1; SMN2

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