SCHEMBL2555535

SCHEMBL2555535

CC(Oc1cc(OCc2ccccc2)ccc1C=O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ERN1 O75460 2/20 0.49
▸ LMNA P02545 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ MAOB P27338 4/20 0.46
▸ PPARG P37231 3/20 0.46
▸ PPARA Q07869 3/20 0.46
▸ MAOA P21397 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ ALOX5 P09917 1/20 0.45
▸ EDNRA P25101 1/20 0.44
▸ NMT1 P30419 1/20 0.44
▸ PPARD Q03181 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
SCHEMBL2354146 0.87 MAOB (0.50) ERN1LMNAL3MBTL1MAOBMAOA
SCHEMBL15331034 0.82 ERN1 (0.47) ERN1LMNAL3MBTL1MAOBHDAC8
SCHEMBL5113685 0.82 HDAC8 (0.52) ERN1LMNAL3MBTL1MAOBMAOA
SCHEMBL865350 0.81 MAOA (0.58) ERN1MAOBMAOAHDAC8ALOX5
SCHEMBL15329865 0.80 ALDH1A1 (0.61) ERN1
SCHEMBL435043 0.80 ALDH1A1 (0.61) ERN1MAOBMAOAHDAC8ALOX5
SCHEMBL3370062 0.79 MAOB (0.52) ERN1LMNAMAOBMAOAHDAC8
SCHEMBL28165618 0.79 MAOB (0.60) LMNAL3MBTL1MAOBPPARGPPARA
SCHEMBL31562367 0.79 HDAC8 (0.49) ERN1LMNAL3MBTL1MAOBPPARG
SCHEMBL5111673 0.79 LMNA (0.74) LMNAL3MBTL1MAOBPPARGPPARA

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
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