SCHEMBL10580139

SCHEMBL10580139

OCC=CC=Cc1ccc(Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC2 Q92769 2/20 0.50
▸ HDAC3 O15379 1/20 0.50
▸ HDAC4 P56524 1/20 0.50
▸ HDAC1 Q13547 1/20 0.50
▸ HDAC7 Q8WUI4 1/20 0.50
▸ HDAC10 Q969S8 1/20 0.50
▸ HDAC11 Q96DB2 1/20 0.50
▸ HDAC8 Q9BY41 1/20 0.50
▸ HDAC6 Q9UBN7 1/20 0.50
▸ HDAC9 Q9UKV0 1/20 0.50
▸ HDAC5 Q9UQL6 1/20 0.50
▸ CYP1A2 P05177 1/20 0.45
▸ AHR P35869 1/20 0.43
▸ MAOB P27338 4/20 0.42
▸ MAOA P21397 2/20 0.42
▸ APP P05067 1/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ PTGS1 P23219 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.38

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
SCHEMBL79527 0.85 ALDH1A1 (0.52) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL79528 0.85 ALDH1A1 (0.52) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL11451994 0.82 HDAC3 (0.59) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL2622607 0.82 HDAC3 (0.59) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL18417175 0.79 HDAC3 (0.57) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL24611334 0.79 HSD11B1 (0.45) APPALOX5PTGS1PTGS2ALDH1A1
SCHEMBL10533955 0.79 CA1 (0.45) APPALOX5PTGS1PTGS2ALDH1A1
SCHEMBL28423958 0.79 APP (0.64) MAOBMAOAAPPALDH1A1CYP3A4
SCHEMBL10740888 0.78 MAOB (0.64) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL10744046 0.78 MAOB (0.64) HDAC2HDAC3HDAC4HDAC1HDAC7

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-0300713-A1 Magnetic circuit HITACHI, LTD. (JP) 1989-01-25 — — EP disclosed
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