SCHEMBL9464178

SCHEMBL9464178

CC(=O)OCOC(COc1ccccc1)C(Oc1ccccc1)C(C)=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.44
▸ PPARA Q07869 2/20 0.44
▸ MTNR1A P48039 4/20 0.43
▸ MTNR1B P49286 4/20 0.43
▸ LMNA P02545 3/20 0.41
▸ MAPT P10636 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ GLA P06280 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ ACACB O00763 1/20 0.36
▸ ACACA Q13085 1/20 0.36

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
SCHEMBL9464165 0.88 PPARG (0.45) PPARGPPARAMTNR1AMTNR1BLMNA
SCHEMBL9464093 0.80 MTNR1A (0.50) MTNR1AMTNR1BLMNAMAPTGLA
SCHEMBL9196060 0.74 MTNR1A (0.48) MTNR1AMTNR1BLMNAMAPTGLA
SCHEMBL896992 0.74 ALDH1A1 (0.53) MTNR1AMTNR1BLMNAMAPTL3MBTL1
SCHEMBL6351413 0.70 MAPT (0.57) MTNR1AMTNR1BLMNAMAPTPOLB
SCHEMBL29157038 0.69 MTNR1A (0.44) PPARGPPARAMTNR1AMTNR1BLMNA
SCHEMBL8668866 0.68 MAPT (0.54) LMNAMAPTALDH1A1
SCHEMBL10030197 0.68 ALDH1A1 (0.52) MTNR1AMTNR1BLMNAMAPTL3MBTL1
SCHEMBL6360882 0.68 AR (0.61) MTNR1AMTNR1BLMNAMAPTALDH1A1
SCHEMBL4407070 0.68 MTNR1A (0.62) PPARGPPARAMTNR1AMTNR1BLMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5225590-A Alkoxy methyl ether and alkoxy methyl ester derivatives SYNTEX (U.S.A.) INC. (US) 1993-07-06 — — US disclosed
EP-0187297-B1 ALKOXY METHYL ETHER AND ALKOXY METHYL ESTER DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1991-08-21 — — EP disclosed
EP-0187297-A2 Alkoxy methyl ether and alkoxy methyl ester derivatives SYNTEX (U.S.A.) INC. (US) 1986-07-16 — — EP disclosed
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