SCHEMBL2559490

SCHEMBL2559490

CCNC(=O)C(C)Oc1ccc(C=O)cc1OCC

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
SMN1; SMN2 Q16637 3/20 0.53
KDM4E B2RXH2 1/20 0.48
GAA P10253 1/20 0.47
TACR2 P21452 1/20 0.46
TOP2A P11388 5/20 0.44
HPGD P15428 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL29951719 0.89 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2KDM4EHPGDTDP1
SCHEMBL15330643 0.89 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2KDM4EGAATACR2
SCHEMBL29956887 0.86 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2HPGDTDP1MAPT
SCHEMBL15331005 0.84 ALDH1A1 (0.59) ALDH1A1KDM4EGAATACR2TOP2A
SCHEMBL15331683 0.84 SMN1; SMN2 (0.72) ALDH1A1SMN1; SMN2KDM4EGAAHPGD
SCHEMBL15331407 0.83 ALDH1A1 (0.65) ALDH1A1KDM4EGAATACR2TOP2A
SCHEMBL11683846 0.80 ALDH1A1 (0.60) ALDH1A1KDM4EGAATACR2TOP2A
SCHEMBL29951075 0.80 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2KDM4EHPGDTDP1
SCHEMBL29955812 0.80 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2HPGDMAPTLMNA
SCHEMBL1121408 0.80 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KDM4EGAATACR2

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