SCHEMBL27949534

SCHEMBL27949534

Cc1cccc(CC(=O)O)c1.[Zn]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTBP2 P56545 1/20 0.62
▸ POLB P06746 2/20 0.56
▸ AKR1B1 P15121 1/20 0.56
▸ MEN1 O00255 1/20 0.54
▸ FFAR1 O14842 1/20 0.54
▸ TP53 P04637 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ KDM4E B2RXH2 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ CYP3A4 P08684 1/20 0.49
▸ RECQL P46063 1/20 0.49
▸ LTB4R Q15722 1/20 0.48
▸ LTB4R2 Q9NPC1 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ PTGS1 P23219 1/20 0.47

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
SCHEMBL2532630 0.98 CTBP2 (0.64) CTBP2POLBAKR1B1MEN1FFAR1
SCHEMBL504093 0.98 CTBP2 (0.64) CTBP2POLBAKR1B1MEN1FFAR1
SCHEMBL29407189 0.98 CTBP2 (0.64) CTBP2POLBAKR1B1MEN1FFAR1
Hydrochloric Acid SCHEMBL2526973 0.96 CTBP2 (0.62) CTBP2POLBAKR1B1MEN1FFAR1
Ammonia Solution, Strong SCHEMBL22042028 0.96 CTBP2 (0.62) CTBP2POLBAKR1B1MEN1FFAR1
Ammonia Solution, Strong SCHEMBL27920742 0.96 CTBP2 (0.62) CTBP2POLBAKR1B1MEN1FFAR1
SCHEMBL11834577 0.89 CTBP2 (0.55) CTBP2POLBAKR1B1MEN1FFAR1
SCHEMBL8405030 0.89 CTBP2 (0.55) CTBP2POLBAKR1B1MEN1FFAR1
SCHEMBL19746447 0.87 GRIN2D (0.55) CTBP2POLBAKR1B1MEN1FFAR1
SCHEMBL11665551 0.84 CTBP2 (0.50) CTBP2POLBAKR1B1MEN1FFAR1

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
CN-103450783-A Plastic coating with good stability and preparation method thereof WUJIANG YINGLIDA PLASTIC PACKAGE CO LTD 2013-12-18 — — CN disclosed
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