SCHEMBL16093682

SCHEMBL16093682

CCCCOc1cccc2nn(C)c(C=O)c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CSNK1A1 P48729 1/20 0.39
▸ CSNK1D P48730 1/20 0.39
▸ PRKCD Q05655 1/20 0.39
▸ PAK1 Q13153 1/20 0.39
▸ CAMK2B Q13554 1/20 0.39
▸ CAMK2G Q13555 1/20 0.39
▸ CAMK2D Q13557 1/20 0.39
▸ TAOK1 Q7L7X3 1/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ MCHR1 Q99705 2/20 0.37
▸ TLR8 Q9NR97 2/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ RECQL P46063 1/20 0.36

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
SCHEMBL16100279 0.76 CYP1A2 (0.41) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL10351592 0.70 GAA (0.64) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL195416 0.67 ALDH1A1 (0.74) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL14848863 0.66 GAA (0.58) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL2454385 0.65 CYP2C9 (0.47) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL14792955 0.65 ALDH1A1 (0.55) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL30600424 0.65 GAA (0.57) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL30471152 0.64 GAA (0.56) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL14841972 0.64 GAA (0.56) L3MBTL1GAATDP1CYP1A2CYP2C9
SCHEMBL21625777 0.64 GAA (0.56) L3MBTL1GAATDP1CYP1A2CYP2C9

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
EP-2970220-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-01-20 — — EP disclosed
WO-2014153235-A2 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-09-25 — — WO disclosed
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