SCHEMBL1070871

SCHEMBL1070871

CNOC(=O)C=Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
MAPT P10636 4/20 0.53
HDAC3 O15379 3/20 0.53
HDAC4 P56524 3/20 0.53
HDAC1 Q13547 3/20 0.53
HDAC2 Q92769 3/20 0.53
HDAC8 Q9BY41 3/20 0.53
HDAC6 Q9UBN7 3/20 0.53
LMNA P02545 3/20 0.53
ALDH1A1 P00352 2/20 0.53
HDAC7 Q8WUI4 2/20 0.53
HDAC10 Q969S8 2/20 0.53
HDAC11 Q96DB2 2/20 0.53
HDAC9 Q9UKV0 2/20 0.53
HDAC5 Q9UQL6 2/20 0.53
PLIN1 O60240 2/20 0.53
RECQL P46063 2/20 0.53
PLIN5 Q00G26 2/20 0.53
ABHD5 Q8WTS1 2/20 0.53

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
E-Methyl Cinnamate SCHEMBL901224 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL27554805 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL27554806 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL112062 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL101530 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL2425288 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL1862419 0.82 CA12 (0.69) GLATDP1MAPTHDAC3HDAC4
SCHEMBL28968012 0.82 GLA (0.56) GLATDP1MAPTHDAC3HDAC4
SCHEMBL29092879 0.82 GLA (0.56) GLATDP1MAPTHDAC3HDAC4
E-Methyl Cinnamate SCHEMBL11725144 0.81 CA12 (0.67) GLATDP1MAPTHDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101360707-A Thrombopoietin activity modulating compounds and methods LIGAND PHARM INC (US) 2009-02-04 CN claimed
EP-2268285-A1 THERAPEUTIC COMPOUNDS Merck Sharp & Dohme Corp. (US) 2011-01-05 EP disclosed
WO-2009108507-A1 THERAPEUTIC COMPOUNDS MERCK & CO., INC. (US) 2009-09-03 WO disclosed
CN-101360707-A Thrombopoietin activity modulating compounds and methods LIGAND PHARM INC (US) 2009-02-04 CN disclosed