SCHEMBL2553744

SCHEMBL2553744

CC(=O)c1ccc(OC(C)CCC(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.49
PPARA Q07869 1/20 0.49
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 2/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KMT2A Q03164 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GAA P10253 1/20 0.45
MAOB P27338 1/20 0.44
MTNR1A P48039 2/20 0.43
MTNR1B P49286 2/20 0.43
FFAR1 O14842 1/20 0.42
PARP10 Q53GL7 1/20 0.41
MAPK1 P28482 1/20 0.41
PDE4B Q07343 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL11375150 0.83 KDM4E (0.46) POLBKMT2AL3MBTL1MTNR1AMTNR1B
SCHEMBL2554999 0.83 MAOB (0.51) MAPTRAB9AKMT2AMAOBMTNR1A
SCHEMBL11502513 0.83 MTNR1A (0.56) MAPTHPGDRAB9AGAAMTNR1A
SCHEMBL11758882 0.81 L3MBTL1 (0.50) PPARGPPARAMAPTHPGDRAB9A
SCHEMBL15330172 0.80 FFAR1 (0.56) MAPTRAB9ALMNAPOLBL3MBTL1
SCHEMBL31664473 0.80 MAPT (0.53) PPARGPPARAMAPTHPGDRAB9A
SCHEMBL13708745 0.79 MAPT (0.46) PPARGPPARAMAPTHPGDRAB9A
SCHEMBL2556328 0.79 ALDH1A3 (0.54) RAB9AKMT2AMTNR1AMTNR1BFFAR1
SCHEMBL27876841 0.79 FFAR1 (0.48) LMNAPOLBL3MBTL1MTNR1AMTNR1B
SCHEMBL10033597 0.78 GAA (0.50) PPARGPPARAMAPTHPGDRAB9A

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