SCHEMBL10936340

SCHEMBL10936340

COc1ccc(-c2ccc3c(c2O)C(=O)c2ccc(Br)c(O)c2C3=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC4 P56524 1/20 0.53
▸ HDAC2 Q92769 1/20 0.53
▸ HDAC8 Q9BY41 1/20 0.53
▸ ME2 P23368 1/20 0.46
▸ ME1 P48163 1/20 0.46
▸ ME3 Q16798 1/20 0.46
▸ ACLY P53396 1/20 0.45
▸ ESR2 Q92731 2/20 0.45
▸ ESR1 P03372 1/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ LCK P06239 1/20 0.43
▸ PRKACA P17612 1/20 0.43
▸ PRKACG P22612 1/20 0.43
▸ PRKACB P22694 1/20 0.43
▸ ALKBH3 Q96Q83 1/20 0.43
▸ CDK4 P11802 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
SCHEMBL11122148 0.91 HDAC4 (0.62) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10936706 0.82 ACLY (0.55) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10937241 0.82 HDAC4 (0.53) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10935780 0.82 HDAC4 (0.53) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10940628 0.82 HDAC4 (0.53) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL11119370 0.81 HDAC4 (0.59) HDAC4HDAC2HDAC8ACLYMEN1
SCHEMBL11401528 0.77 ACLY (0.50) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10937755 0.77 ACLY (0.56) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10939753 0.76 ACLY (0.55) HDAC4HDAC2HDAC8ME2ME1
SCHEMBL10940643 0.76 ACLY (0.55) HDAC4HDAC2HDAC8ME2ME1

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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