SCHEMBL21917767

SCHEMBL21917767

CCc1cc(-c2ccc(OCCO)cc2)cc(F)c1OCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 5/20 0.45
▸ RARA P10276 1/20 0.45
▸ NR1I2 O75469 1/20 0.43
▸ FFAR1 O14842 3/20 0.42
▸ FFAR4 Q5NUL3 3/20 0.42
▸ PRKAB2 O43741 1/20 0.39
▸ PRKAG1 P54619 1/20 0.39
▸ PRKAA2 P54646 1/20 0.39
▸ PRKAA1 Q13131 1/20 0.39
▸ PRKAG3 Q9UGI9 1/20 0.39
▸ PRKAG2 Q9UGJ0 1/20 0.39
▸ PRKAB1 Q9Y478 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ RECQL P46063 1/20 0.39
▸ GAA P10253 1/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL19794861 0.86 ALDH1A1 (0.47) RARBRARANR1I2FFAR1FFAR4
SCHEMBL19956101 0.82 NR1I2 (0.41) RARBRARANR1I2FFAR1FFAR4
SCHEMBL21917766 0.81 THRB (0.50) RARBRARAFFAR1FFAR4ALDH1A1
SCHEMBL19794868 0.78 RARB (0.42) RARBRARAFFAR1FFAR4PRKAB2
SCHEMBL26427151 0.75 FFAR1 (0.48) RARBRARANR1I2FFAR1FFAR4
SCHEMBL13079624 0.74 ALDH1A1 (0.60) RARBNR1I2PRKAB2PRKAG1PRKAA2
SCHEMBL20672333 0.73 ELANE (0.42) RARBRARAFFAR1FFAR4PRKAB2
SCHEMBL22459324 0.72 ALDH1A1 (0.46) RARBRARANR1I2FFAR1FFAR4
SCHEMBL2720663 0.72 ALDH1A1 (0.68) RARBNR1I2ALDH1A1RECQLGAA
SCHEMBL9119081 0.72 ALDH1A1 (0.68) RARBNR1I2ALDH1A1RECQLGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3293245-B1 REACTIVE MESOGEN AND LIQUID CRYSTAL COMPOSITION INCLUDING THE SAME SAMSUNG DISPLAY CO LTD (KR) 2020-04-15 — — EP disclosed
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