SCHEMBL11405285

SCHEMBL11405285

CC(=O)/C(C)=C/C=C/c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.53
▸ TDP1 Q9NUW8 1/20 0.53
▸ MCL1 Q07820 1/20 0.53
▸ HDAC3 O15379 2/20 0.52
▸ HDAC4 P56524 2/20 0.52
▸ HDAC1 Q13547 2/20 0.52
▸ HDAC7 Q8WUI4 2/20 0.52
▸ HDAC2 Q92769 2/20 0.52
▸ HDAC10 Q969S8 2/20 0.52
▸ HDAC11 Q96DB2 2/20 0.52
▸ HDAC8 Q9BY41 2/20 0.52
▸ HDAC6 Q9UBN7 2/20 0.52
▸ HDAC9 Q9UKV0 2/20 0.52
▸ HDAC5 Q9UQL6 2/20 0.52
▸ GAA P10253 1/20 0.51
▸ MAOB P27338 3/20 0.50
▸ AKR1C3 P42330 1/20 0.48
▸ LMNA P02545 6/20 0.48
▸ ALDH1A1 P00352 5/20 0.48
▸ TRPA1 O75762 1/20 0.48

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
SCHEMBL11405291 1.00 GLA (0.53) GLATDP1MCL1HDAC3HDAC4
SCHEMBL8776436 0.92 HDAC3 (0.53) GLATDP1MCL1HDAC3HDAC4
SCHEMBL16462 0.88 AKR1C3 (0.59) GLATDP1MCL1HDAC3HDAC4
SCHEMBL693055 0.88 AKR1C3 (0.59) GLATDP1MCL1HDAC3HDAC4
SCHEMBL10454886 0.88 AKR1C3 (0.59) GLATDP1MCL1HDAC3HDAC4
SCHEMBL28318920 0.85 AKR1C3 (0.52) GLATDP1MCL1HDAC3HDAC4
SCHEMBL24611326 0.85 MCL1 (0.58) GLATDP1MCL1HDAC3HDAC4
SCHEMBL11275401 0.85 AKR1C3 (0.50) GLATDP1MCL1HDAC3HDAC4
SCHEMBL3086266 0.85 MCL1 (0.58) GLATDP1MCL1HDAC3HDAC4
SCHEMBL11270131 0.85 AKR1C3 (0.50) GLATDP1MCL1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4262013-A ANTILIPEMIC AGENTS SANKYO COMPANY LIMITED (JP) 1981-04-14 — — US disclosed
US-4198425-A ANTILIPEMIC AGENTS SANKYO COMPANY LIMITED (JP) 1980-04-15 — — US disclosed
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