SCHEMBL2556045

SCHEMBL2556045

CC(=O)CCc1ccc(OCC=CC(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
MAPT P10636 1/20 0.46
MAOA P21397 1/20 0.46
SLC6A2 P23975 1/20 0.46
RAB9A P51151 1/20 0.46
SLC6A3 Q01959 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
FFAR1 O14842 6/20 0.44
PPARD Q03181 1/20 0.44
FFAR4 Q5NUL3 2/20 0.43
NDUFS8 O00217 1/20 0.42

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
SCHEMBL2556043 1.00 MEN1 (0.51) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL10799299 0.84 MEN1 (0.49) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL8417675 0.80 MEN1 (0.67) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL10805062 0.80 NDUFS8 (0.53) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL24723779 0.80 LMNA (0.55) LMNAL3MBTL1FFAR1PPARDFFAR4
SCHEMBL24993384 0.80 ATG4B (0.58) MEN1KMT2AALDH1A1LMNACYP1A2
SCHEMBL31325417 0.80 MEN1 (0.46) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL31325387 0.80 MEN1 (0.46) MEN1KMT2AALDH1A1LMNAL3MBTL1
SCHEMBL6858638 0.77 LMNA (0.62) LMNAL3MBTL1FFAR1PPARDFFAR4
SCHEMBL6858644 0.77 LMNA (0.62) LMNAL3MBTL1FFAR1PPARDFFAR4

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