SCHEMBL28601651

SCHEMBL28601651

CCCCC(=O)Nc1cccc2cccnc12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.76
HDAC6 Q9UBN7 4/20 0.72
HDAC1 Q13547 4/20 0.72
HDAC3 O15379 3/20 0.72
HDAC4 P56524 3/20 0.72
HDAC7 Q8WUI4 3/20 0.72
HDAC2 Q92769 3/20 0.72
HDAC10 Q969S8 3/20 0.72
HDAC11 Q96DB2 3/20 0.72
HDAC8 Q9BY41 3/20 0.72
HDAC9 Q9UKV0 3/20 0.72
HDAC5 Q9UQL6 3/20 0.72
POLB P06746 3/20 0.71
TDP1 Q9NUW8 2/20 0.66
LMNA P02545 3/20 0.58
MAPT P10636 2/20 0.58
HPGD P15428 1/20 0.58
TSHR P16473 1/20 0.58
ALDH1A1 P00352 1/20 0.56
KMT2A Q03164 2/20 0.55

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
SCHEMBL9545906 0.95 HDAC1 (0.77) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL28257108 0.92 POLB (0.74) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL9464308 0.91 HTT (0.89) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL9464627 0.88 POLB (0.88) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL15923232 0.88 HDAC1 (0.67) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL30444767 0.88 HDAC1 (0.79) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL11252751 0.87 HTT (0.78) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL27922836 0.86 HTT (0.72) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL28340846 0.86 HTT (0.61) HTTHDAC6HDAC1HDAC3HDAC4
SCHEMBL8401892 0.85 TDP1 (0.73) HTTHDAC6HDAC1HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113121433-A Synthesis method of N-8-quinolyl-2-aminobenzamide compound 信阳师范学院 2021-07-16 CN claimed
CN-113121433-B Synthesis method of N-8-quinolyl-2-aminobenzamide compound 信阳师范学院 2022-07-15 CN disclosed
CN-113121433-B Synthesis method of N-8-quinolyl-2-aminobenzamide compound 信阳师范学院 2022-07-15 CN disclosed
CN-113121433-A Synthesis method of N-8-quinolyl-2-aminobenzamide compound 信阳师范学院 2021-07-16 CN disclosed
CN-113121433-A Synthesis method of N-8-quinolyl-2-aminobenzamide compound 信阳师范学院 2021-07-16 CN disclosed