SCHEMBL28741972

SCHEMBL28741972

NC(=O)N(CCO)Cc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.54
ALDH1A1 P00352 3/20 0.51
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
LIMK2 P53671 1/20 0.49
LMNA P02545 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.49
GAA P10253 2/20 0.48
REN P00797 2/20 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
SCHEMBL3900020 0.89 HDAC1 (0.53) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL2919355 0.87 GRIN2D (0.49) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL766565 0.86 L3MBTL1 (0.58) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL1386528 0.86 LMNA (0.57) ALDH1A1HDAC3HDAC1HDAC7HDAC10
SCHEMBL3422890 0.85 MEN1 (0.56) L3MBTL1HDAC1HDAC6LIMK2LMNA
SCHEMBL3920435 0.84 LMNA (0.56) ALDH1A1HDAC1HDAC6LMNAMEN1
SCHEMBL678725 0.81 L3MBTL1 (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL1341392 0.81 GAA (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL8615545 0.81 LIMK2 (0.63) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL27754647 0.81 L3MBTL1 (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1

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-1237593-A Cyanoacetylureas for stabilizing halogenated polymers WITCO VINYL ADDITIVES GMBH (DE) 1999-12-08 CN disclosed