SCHEMBL4073741

SCHEMBL4073741

Cc1cc(C)cc(C=NNC(=O)CCCNc2ccc(C(=O)NN=Cc3cc(C)cc(C)c3)cc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.48
KMT2A Q03164 6/20 0.48
MAPT P10636 6/20 0.48
KDM4E B2RXH2 4/20 0.48
TDP1 Q9NUW8 3/20 0.48
TP53 P04637 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.47
ASF1A Q9Y294 2/20 0.46
POLB P06746 2/20 0.46
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
NPC1 O15118 3/20 0.45
CYP2C9 P11712 1/20 0.45
HPGD P15428 1/20 0.45
CYP2C19 P33261 1/20 0.45
GAA P10253 2/20 0.44
SAE1 Q9UBE0 1/20 0.44
UBA2 Q9UBT2 1/20 0.44

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
SCHEMBL13568977 1.00 MEN1 (0.48) MEN1KMT2AMAPTKDM4ETDP1
SCHEMBL13568976 0.92 MAPT (0.49) MEN1KMT2AMAPTSMN1; SMN2ASF1A
SCHEMBL13568966 0.87 POLB (0.50) MEN1KMT2AMAPTKDM4ETDP1
SCHEMBL4074336 0.86 MAPT (0.53) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL13569076 0.86 MAPT (0.53) MEN1KMT2AMAPTTDP1SMN1; SMN2
SCHEMBL13569037 0.85 RAB9A (0.66) MEN1KMT2AMAPTTDP1RAB9A
SCHEMBL4082049 0.85 RAB9A (0.66) MEN1KMT2AMAPTTDP1RAB9A
SCHEMBL4074184 0.85 RAB9A (0.60) MEN1KMT2AMAPTKDM4ERAB9A
SCHEMBL13568880 0.85 RAB9A (0.60) MEN1KMT2AMAPTKDM4ERAB9A
SCHEMBL4075143 0.83 GRK2 (0.62) MEN1KMT2AMAPTKDM4ETDP1

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-2009155362-A1 SMALL MOLECULE HEMATOPOIETIC GROWTH FACTOR MIMETIC COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2009-12-23 WO disclosed