SCHEMBL27643302

SCHEMBL27643302

CC(C=O)CC(=O)Nc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 2/20 0.61
▸ LMNA P02545 1/20 0.61
▸ TSHR P16473 1/20 0.58
▸ HDAC2 Q92769 5/20 0.51
▸ HDAC3 O15379 4/20 0.51
▸ HDAC4 P56524 4/20 0.51
▸ HDAC1 Q13547 4/20 0.51
▸ HDAC7 Q8WUI4 4/20 0.51
▸ HDAC10 Q969S8 4/20 0.51
▸ HDAC11 Q96DB2 4/20 0.51
▸ HDAC8 Q9BY41 4/20 0.51
▸ HDAC6 Q9UBN7 4/20 0.51
▸ HDAC9 Q9UKV0 4/20 0.51
▸ HDAC5 Q9UQL6 4/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ PTPN1 P18031 1/20 0.50
▸ MAPT P10636 3/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL3021548 0.82 LMNA (0.86) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL5907668 0.80 HPGD (0.67) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL9810823 0.79 LMNA (0.65) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL3026961 0.79 HPGD (0.65) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL29828407 0.79 HPGD (0.65) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL11430509 0.79 LMNA (0.65) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL10931873 0.77 POLB (0.63) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL30805754 0.77 CA1 (0.63) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL7544322 0.77 CA1 (0.63) HPGDLMNATSHRHDAC2HDAC3
SCHEMBL27690465 0.76 GAA (0.61) LMNAHDAC2HDAC3HDAC4HDAC1

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
CN-1775750-A One-step method for synthesizing pyridaben by nucleo philic substitution reaction UNIV DONGBEI NORMAL (CN) 2006-05-24 — — CN disclosed
CN-87106032-A Dihydropyridine anti-allergic agent and anti-inflammatory agent — 1988-03-23 — — CN disclosed
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