SCHEMBL10938425

SCHEMBL10938425

CCOc1ccc(-c2ccc3c(c2O)C(=O)c2ccc(Cl)c(O)c2C3=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 2/20 0.47
▸ FFAR4 Q5NUL3 1/20 0.47
▸ ERN1 O75460 2/20 0.44
▸ PRKAB2 O43741 2/20 0.42
▸ PRKAG1 P54619 2/20 0.42
▸ PRKAA2 P54646 2/20 0.42
▸ PRKAA1 Q13131 2/20 0.42
▸ PRKAG3 Q9UGI9 2/20 0.42
▸ PRKAG2 Q9UGJ0 2/20 0.42
▸ PRKAB1 Q9Y478 2/20 0.42
▸ TAS1R3 Q7RTX0 1/20 0.40
▸ TAS1R1 Q7RTX1 1/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HSP90AA1 P07900 1/20 0.39
▸ HSP90AB1 P08238 1/20 0.39
▸ SRD5A2 P31213 1/20 0.39
▸ MAPT P10636 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39

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
SCHEMBL10936447 0.89 MAOB (0.44) FFAR1FFAR4ERN1MEN1KMT2A
SCHEMBL10934578 0.89 NPC1 (0.46) FFAR1FFAR4MEN1KMT2AMAPT
SCHEMBL10937359 0.87 NR5A1 (0.46) FFAR1FFAR4MEN1KMT2AMAPT
SCHEMBL10936357 0.86 NR5A1 (0.48) FFAR1FFAR4MEN1KMT2AMAPT
SCHEMBL10938465 0.86 NR5A1 (0.48) FFAR1FFAR4MEN1KMT2AMAPT
SCHEMBL10934038 0.86 NR5A1 (0.48) FFAR1FFAR4MEN1KMT2AMAPT
SCHEMBL10937940 0.84 KMT2A (0.45) FFAR1FFAR4ERN1PRKAB2PRKAG1
SCHEMBL10937241 0.84 HDAC4 (0.53) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL11120685 0.77 NR5A1 (0.53) MEN1KMT2AMAPTNPC1RAB9A
SCHEMBL10937987 0.77 FFAR1 (0.42) FFAR1FFAR4ERN1PRKAB2PRKAG1

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
US-4532069-A For electro-optical display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1985-07-30 — — US disclosed
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