SCHEMBL11711745

SCHEMBL11711745

O=C(Cl)Oc1ccc(C2CCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC8 Q9BY41 2/20 0.47
▸ HDAC6 Q9UBN7 2/20 0.47
▸ HDAC1 Q13547 1/20 0.47
▸ HRH3 Q9Y5N1 2/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HAO1 Q9UJM8 2/20 0.41
▸ ACMSD Q8TDX5 2/20 0.41
▸ FAAH O00519 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ GLA P06280 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ POLB P06746 1/20 0.40

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
SCHEMBL238310 0.83 HDAC8 (0.49) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL7510922 0.81 HAO1 (0.49) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL1790363 0.81 LMNA (0.52) HDAC8HDAC6HDAC1SMN1; SMN2KMT2A
SCHEMBL1790802 0.80 MAPT (0.50) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL9709523 0.80 KMT2A (0.48) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL987605 0.80 HRH3 (0.43) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL233920 0.79 SMN1; SMN2 (0.45) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL5185070 0.79 KMT2A (0.70) HDAC8HDAC6HDAC1SMN1; SMN2KMT2A
SCHEMBL2582818 0.77 THRB (0.45) HDAC8HDAC6HDAC1HRH3SMN1; SMN2
SCHEMBL248211 0.77 ALDH1A1 (0.51) HDAC8HDAC6HDAC1HRH3SMN1; SMN2

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-4059615-A INSECTICIDE, POLYMER INTERMEDIATE HOOKER CHEMICALS & PLASTICS CORPORATION (US) 1977-11-22 — — US disclosed
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