SCHEMBL2554944

SCHEMBL2554944

CCC(CC)(Oc1ccc(C(C)=O)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.50
HPGD P15428 1/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
GAA P10253 1/20 0.47
MAOB P27338 4/20 0.46
KMT2A Q03164 2/20 0.45
LMNA P02545 3/20 0.45
POLB P06746 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ADORA3 P0DMS8 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
STS P08842 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MAOA P21397 1/20 0.42
HTT P42858 1/20 0.42
PPARA Q07869 2/20 0.41
HSD17B10 Q99714 1/20 0.41
PPARG P37231 1/20 0.41

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
SCHEMBL2555820 0.83 ADORA3 (0.58) MAPTHPGDRAB9AL3MBTL1GAA
SCHEMBL23754112 0.82 PPARG (0.45) MAPTL3MBTL1KMT2ANPSR1ADORA3
SCHEMBL15330389 0.81 MAOB (0.52) MAPTRAB9AMAOBKMT2APOLB
SCHEMBL27571634 0.81 GAA (0.44) MAPTHPGDGAAKMT2AADORA3
SCHEMBL11763480 0.80 PPARG (0.44) MAPTL3MBTL1KMT2ANPSR1ADORA3
SCHEMBL11540230 0.78 ALDH1A1 (0.44) MAPTHPGDKMT2ALMNAADORA3
SCHEMBL2560059 0.77 L3MBTL1 (0.50) MAPTHPGDRAB9AL3MBTL1GAA
SCHEMBL7561322 0.77 PPARA (0.50) MAPTRAB9AMAOBKMT2ALMNA
SCHEMBL2560853 0.77 PPARA (0.65) MAPTHPGDRAB9AL3MBTL1GAA
SCHEMBL2555649 0.75 MAPT (0.53) MAPTHPGDRAB9AL3MBTL1GAA

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