SCHEMBL2554985

SCHEMBL2554985

CCC(C)(Oc1cccc(C=O)c1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.48
PPARA Q07869 6/20 0.48
MAOA P21397 5/20 0.46
MAOB P27338 5/20 0.46
UNG P13051 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
SRC P12931 1/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
FBP1 P09467 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
POLB P06746 1/20 0.41
TRIM24 O15164 1/20 0.40
TRIM33 Q9UPN9 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
SCHEMBL15329910 0.89 SMN1; SMN2 (0.44) PPARGPPARAMAOAMAOBUNG
SCHEMBL2556213 0.86 MAOA (0.43) PPARGPPARAMAOAMAOBUNG
SCHEMBL2559935 0.85 MAOA (0.43) PPARGPPARAMAOAMAOBUNG
SCHEMBL2560320 0.84 MAOA (0.47) PPARGPPARAMAOAMAOBUNG
SCHEMBL15329664 0.84 SRC (0.43) PPARAMAOAMAOBUNGSRC
SCHEMBL2553855 0.83 MAOA (0.41) PPARGPPARAMAOAMAOBUNG
SCHEMBL14184550 0.82 PPARG (0.52) PPARGPPARAADORA3NPC1RAB9A
SCHEMBL2174559 0.82 PPARA (0.51) PPARGPPARAMAOAMAOBUNG
SCHEMBL3828823 0.82 PPARG (0.52) PPARGPPARAADORA3NPC1RAB9A
SCHEMBL2558556 0.82 ADORA3 (0.56) PPARGPPARAADORA3ALDH1A1SMN1; 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