SCHEMBL11287145

SCHEMBL11287145

CC(C)COC(=O)C(C)Oc1ccc(Oc2ccc3ccccc3c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ L3MBTL1 Q9Y468 3/20 0.44
▸ PPARG P37231 3/20 0.44
▸ PPARA Q07869 3/20 0.44
▸ RECQL P46063 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ PTGS2 P35354 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ LNPEP Q9UIQ6 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ CYP2C19 P33261 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
SCHEMBL11276002 0.85 MAPT (0.53) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL11281849 0.83 LMNA (0.44) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL11187437 0.81 CYP1A2 (0.61) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL28257654 0.81 LMNA (0.54) MAPTLMNAL3MBTL1ALDH1A1TSHR
SCHEMBL11281808 0.80 SIRT2 (0.49) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL163796 0.80 CYP1A2 (0.50) MAPTL3MBTL1PPARGPPARAPOLB
SCHEMBL3993398 0.80 LMNA (0.61) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL11281839 0.78 RECQL (0.43) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL9579919 0.76 RECQL (0.57) MAPTLMNASMN1; SMN2L3MBTL1PPARG
SCHEMBL29408328 0.76 RECQL (0.57) MAPTLMNASMN1; SMN2L3MBTL1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0001804-B1 BETA-NAPHTHYL- AND BETA-TETRAHYDRONAPHTHYLPHENYL ETHERS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-19 — — EP disclosed
EP-0001804-A1 Beta-naphthyl- and beta-tetrahydronaphthylphenyl ethers, process for their preparation and their use as herbicides HOECHST AKTIENGESELLSCHAFT (DE) 1979-05-16 — — EP disclosed
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