SCHEMBL13001971

SCHEMBL13001971

CNc1cccc(C(=O)NCc2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC6 Q9UBN7 2/20 0.66
▸ HDAC2 Q92769 1/20 0.66
▸ HDAC8 Q9BY41 1/20 0.66
▸ MAPK1 P28482 2/20 0.63
▸ LMNA P02545 1/20 0.63
▸ ALDH1A1 P00352 4/20 0.62
▸ GAA P10253 1/20 0.62
▸ HSD17B10 Q99714 1/20 0.62
▸ SIRT2 Q8IXJ6 1/20 0.61
▸ HTT P42858 3/20 0.60
▸ HPGD P15428 2/20 0.60
▸ KMT2A Q03164 2/20 0.59
▸ CFD P00746 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ HDAC1 Q13547 1/20 0.57
▸ PPARG P37231 2/20 0.57
▸ RAB9A P51151 2/20 0.56
▸ EPHX2 P34913 1/20 0.56
▸ NR1H4 Q96RI1 1/20 0.56
▸ NPC1 O15118 1/20 0.56

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
SCHEMBL11900328 0.85 HDAC6 (0.87) HDAC6HDAC2HDAC8ALDH1A1GAA
SCHEMBL10294849 0.85 HDAC8 (0.62) HDAC6HDAC2HDAC8MAPK1LMNA
SCHEMBL16598155 0.85 HDAC6 (0.66) HDAC6HDAC2HDAC8MAPK1LMNA
SCHEMBL27952268 0.85 LMNA (0.70) HDAC6HDAC2HDAC8MAPK1LMNA
SCHEMBL22047184 0.82 PPARG (0.78) HDAC6HDAC2HDAC8LMNAALDH1A1
SCHEMBL10084687 0.81 NPC1 (0.73) HDAC6HDAC2HDAC8MAPK1LMNA
SCHEMBL14044800 0.81 HDAC2 (0.69) HDAC6HDAC2HDAC8ALDH1A1GAA
SCHEMBL13702290 0.81 HDAC6 (0.74) HDAC6HDAC2HDAC8ALDH1A1GAA
SCHEMBL20095441 0.81 SMN1; SMN2 (0.51) LMNAALDH1A1GAAHSD17B10KMT2A
SCHEMBL7803055 0.80 KDR (0.58) HDAC6HDAC2HDAC8MAPK1LMNA

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-2010144359-A1 TRIAZINE DERIVATIVES AND THEIR THERAPEUTICAL APPLICATIONS ABRAXIS BIOSCIENCE, LLC (US) 2010-12-16 — — WO disclosed
Send feedback