SCHEMBL27615543

SCHEMBL27615543

C=CC(=O)OCCCOc1ccc(COCc2ccccc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.62
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ FFAR1 O14842 4/20 0.46
▸ MAPT P10636 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ TSHR P16473 2/20 0.44
▸ HPGD P15428 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ FFAR4 Q5NUL3 1/20 0.43
▸ TEAD3 Q99594 1/20 0.43
▸ NR4A1 P22736 1/20 0.43
▸ NR4A2 P43354 1/20 0.43
▸ NR4A3 Q92570 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ HTT P42858 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
SCHEMBL489015 0.87 TEAD3 (0.54) THRBALDH1A1L3MBTL1TSHRHPGD
SCHEMBL69211 0.85 THRB (0.84) THRBALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL16893759 0.83 THRB (0.69) THRBALDH1A1FFAR1TSHRHPGD
SCHEMBL21947597 0.83 THRB (0.79) THRBFFAR1FFAR4
SCHEMBL22451265 0.83 THRB (0.64) THRBALDH1A1FFAR1L3MBTL1TSHR
SCHEMBL12219943 0.83 THRB (0.59) THRBALDH1A1KDM4EMAPTL3MBTL1
SCHEMBL1031149 0.82 THRB (0.84) THRBALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL27804950 0.82 THRB (0.57) THRBNPC1RAB9AALDH1A1KDM4E
SCHEMBL19672885 0.82 THRB (0.53) THRBNPC1RAB9AALDH1A1KDM4E
Ethylene Glycol SCHEMBL1087639 0.81 THRB (0.58) THRBALDH1A1TSHRCYP3A4TEAD3

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
CN-100423102-C Birefringent optical component KONINKL PHILIPS ELECTRONICS NV (NL) 2008-10-01 — — CN disclosed
CN-1732520-A Birefringent optical component KONINKL PHILIPS ELECTRONICS NV (NL) 2006-02-08 — — CN disclosed
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