SCHEMBL27759813

SCHEMBL27759813

CCCCCCCC(=O)C(C(=O)OCC)c1ccc(OCc2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ LPAR1 Q92633 2/20 0.48
▸ LPAR3 Q9UBY5 2/20 0.48
▸ CTRC Q99895 1/20 0.47
▸ NR1H4 Q96RI1 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ ENPP2 Q13822 1/20 0.47

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
SCHEMBL27759836 1.00 LMNA (0.55) LMNAL3MBTL1LPAR1LPAR3CTRC
SCHEMBL27739171 0.88 KMT2A (0.48) LMNAL3MBTL1
SCHEMBL27739165 0.88 KMT2A (0.48) LMNAL3MBTL1
SCHEMBL27759839 0.88 KMT2A (0.48) LMNAL3MBTL1
SCHEMBL2716599 0.85 LMNA (0.68) LMNAL3MBTL1NR1H4ALDH1A1
SCHEMBL27900716 0.83 LMNA (0.65) LMNAL3MBTL1NR1H4ALDH1A1
SCHEMBL2348796 0.82 LMNA (0.55) LMNAL3MBTL1NR1H4ALDH1A1
SCHEMBL6311563 0.82 LMNA (0.64) LMNAL3MBTL1NR1H4ALDH1A1
SCHEMBL22497335 0.81 LMNA (0.57) LMNAL3MBTL1CTRCNR1H4ALDH1A1
SCHEMBL28842185 0.81 LMNA (0.57) LMNAL3MBTL1CTRCNR1H4ALDH1A1

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-101407459-B Monohydroxy-2-acyl phenylacetate, and preparation and use thereof UNIV XIAMEN 2013-03-27 — — CN disclosed
CN-101407459-A Monohydroxy-2-acyl phenylacetate, and preparation and use thereof UNIV XIAMEN (CN) 2009-04-15 — — CN disclosed
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