SCHEMBL7979522

SCHEMBL7979522

CCNC(=O)c1ccc(N)s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.58
HDAC1 Q13547 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
POLB P06746 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 1/20 0.45
HSP90AB1 P08238 4/20 0.43
GAA P10253 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ESR1 P03372 1/20 0.41
HPGD P15428 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 4/20 0.41
HSD17B10 Q99714 2/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL6977403 0.86 KDM4E (0.50) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL18239527 0.79 HDAC4 (0.65) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL17401233 0.79 HDAC6 (0.65) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL16011573 0.79 HDAC4 (0.65) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL12124277 0.79 KMT2A (0.69) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL17629364 0.79 KDM4E (0.53) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL14421254 0.78 HDAC8 (0.52) HDAC4HDAC1HDAC6GAANPSR1
SCHEMBL12313374 0.78 RAB9A (0.63) HDAC4HDAC1HDAC6POLBKMT2A
SCHEMBL14627824 0.78 MAPK1 (0.64) HDAC4HDAC1HDAC6KMT2ATDP1
SCHEMBL16315254 0.78 GAA (0.69) HDAC4HDAC1HDAC6POLBKMT2A

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
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 WO disclosed