SCHEMBL2409902

SCHEMBL2409902

COc1ccc(NC(=O)NCCc2ccc(C(=O)NO)cc2)c(OC)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.63
MEN1 O00255 3/20 0.63
MAPT P10636 4/20 0.58
HDAC1 Q13547 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
HDAC11 Q96DB2 1/20 0.57
ALDH1A1 P00352 3/20 0.55
LMNA P02545 2/20 0.55
GAA P10253 2/20 0.55
ALOX12 P18054 1/20 0.55
HTT P42858 1/20 0.55
TP53 P04637 1/20 0.55
NPC1 O15118 1/20 0.55
AHR P35869 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
HPGD P15428 1/20 0.55
FPR2 P25090 1/20 0.52

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
SCHEMBL8926644 0.81 KMT2A (0.64) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL6570625 0.79 RAB9A (0.70) KMT2AMEN1MAPTHDAC1HDAC6
SCHEMBL2407648 0.76 KMT2A (0.62) KMT2AMEN1MAPTHDAC1HDAC6
SCHEMBL2412015 0.76 HDAC1 (0.61) KMT2AMEN1HDAC1HDAC6HDAC11
SCHEMBL31680510 0.76 SMN1; SMN2 (0.88) KMT2AMEN1MAPTALDH1A1LMNA
SCHEMBL19472833 0.76 PLK1 (0.64) KMT2AMEN1ALDH1A1LMNANPC1
SCHEMBL3031951 0.76 RAB9A (0.65) KMT2AMEN1MAPTHDAC1HDAC6
SCHEMBL19478605 0.75 PLK1 (0.66) KMT2AMEN1LMNANPC1AHR
SCHEMBL24711273 0.75 LMNA (0.86) KMT2AMEN1MAPTHDAC1HDAC6
SCHEMBL3028816 0.75 RAB9A (0.63) KMT2AMEN1MAPTHDAC1HDAC6

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-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed