SCHEMBL10599264

SCHEMBL10599264

CCOC(=O)c1ccccc1OCC(O)COCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 1/20 0.50
▸ ADRB2 P07550 1/20 0.48
▸ ADRB1 P08588 1/20 0.48
▸ ADRB3 P13945 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ TSHR P16473 2/20 0.48
▸ ABCB1 P08183 5/20 0.47
▸ PPIA P62937 1/20 0.47
▸ KCNH2 Q12809 1/20 0.46

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
SCHEMBL21647724 0.86 ABCB1 (0.44) ADRB2ADRB1ADRB3TSHRABCB1
SCHEMBL340937 0.83 HTT (0.69) HTTL3MBTL1TSHRPPIA
SCHEMBL28965964 0.81 TSHR (0.52) ADRB2ADRB1ADRB3L3MBTL1TSHR
SCHEMBL10599258 0.81 MAPT (0.62) ADRB2ADRB1ADRB3L3MBTL1TSHR
SCHEMBL14430331 0.80 HTT (0.66) HTTADRB2ADRB1ADRB3L3MBTL1
SCHEMBL11842718 0.79 TSHR (0.49) ADRB2ADRB1ADRB3TSHRABCB1
SCHEMBL14822991 0.79 KDM4E (0.62) ADRB2ADRB1ADRB3
SCHEMBL29191526 0.78 PTGER1 (0.49) —
SCHEMBL28020536 0.77 TSHR (0.61) HTTADRB2ADRB1ADRB3TSHR
SCHEMBL27898281 0.77 L3MBTL1 (0.66) HTTL3MBTL1TSHR

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-0175325-B1 NEW 8-SUBSTITUTED NUCLEOSIDE AND PURINE DERIVATIVES, THE PROCESS FOR THE PREPARATION THEREOF AND THE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Pierrel S.p.A. (IT) 1989-03-15 — — EP disclosed
US-4774325-A ANTILIPEMIC AGENTS PIERREL SPA (IT) 1988-09-27 — — US disclosed
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