SCHEMBL3907983

SCHEMBL3907983

O=CC(=Cc1ccccc1)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.51
▸ NR1H4 Q96RI1 1/20 0.48
▸ ALDH1A1 P00352 5/20 0.47
▸ HCAR2 Q8TDS4 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ TDP1 Q9NUW8 2/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ SLC6A3 Q01959 1/20 0.46
▸ TSHR P16473 1/20 0.44
▸ CA12 O43570 2/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ AKR1B10 O60218 2/20 0.44
▸ AKR1B1 P15121 2/20 0.44
▸ CA4 P22748 1/20 0.44
▸ CA6 P23280 1/20 0.44
▸ CA5A P35218 1/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA14 Q9ULX7 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
SCHEMBL22394368 0.81 ALDH1A1 (0.55) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL10592490 0.80 MEN1 (0.61) LMNANR1H4ALDH1A1KMT2ATDP1
SCHEMBL10592487 0.80 MEN1 (0.61) LMNANR1H4ALDH1A1KMT2ATDP1
SCHEMBL629563 0.77 CYP3A4 (0.47) LMNAALDH1A1KMT2ATDP1MAPK1
SCHEMBL2393862 0.76 ALDH1A1 (0.49) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL2393858 0.76 ALDH1A1 (0.49) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL5902084 0.76 ALDH1A1 (0.49) LMNAALDH1A1HCAR2KMT2ATDP1
SCHEMBL12500129 0.75 LMNA (0.56) LMNANR1H4ALDH1A1HCAR2KMT2A
SCHEMBL5311037 0.75 LMNA (0.56) LMNANR1H4ALDH1A1HCAR2KMT2A
SCHEMBL1554195 0.75 LMNA (0.51) LMNANR1H4ALDH1A1HCAR2KMT2A

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
EP-2015645-A2 EXTRACTS AND METHODS COMPRISING CINNAMON SPECIES Herbalscience Singapore Pte. Ltd. (US) 2009-01-21 — — EP disclosed
WO-2007109804-A2 EXTRACTS AND METHODS COMPRISING CINNAMON SPECIES HERBALSCIENCE SINGAPORE PTE. LTD. (US) 2007-09-27 — — WO disclosed
US-6548096-B1 Aspartyl dipeptide ester derivatives and sweeteners AJINOMOTO CO., INC. (JP) 2003-04-15 — — US disclosed
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