SCHEMBL7202009

SCHEMBL7202009

Cc1ccc(N(C)C(=O)c2c(O)c3c(N(C)C)cccc3n(C)c2=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.58
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
PGR P06401 1/20 0.57
SRC P12931 1/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
TP53 P04637 1/20 0.39
HSD17B1 P14061 2/20 0.39
HSD17B2 P37059 2/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 2/20 0.38
POLB P06746 2/20 0.37
PABPC1 P11940 1/20 0.37
NLRP3 Q96P20 1/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL10675692 0.92 KMT2A (0.68) HDAC4MEN1KMT2APGRSRC
SCHEMBL5163633 0.89 HDAC4 (0.62) HDAC4MEN1KMT2APGRSRC
SCHEMBL5165352 0.86 HDAC4 (0.58) HDAC4MEN1KMT2APGRSRC
SCHEMBL19398184 0.84 HDAC4 (0.79) HDAC4MEN1KMT2APGRSRC
SCHEMBL7200053 0.82 HDAC4 (0.54) HDAC4MEN1KMT2APGRSRC
SCHEMBL5167153 0.81 MEN1 (0.70) HDAC4MEN1KMT2APGRSRC
SCHEMBL5166744 0.81 HDAC4 (0.57) HDAC4MEN1KMT2APGRSRC
SCHEMBL5165226 0.80 ALDH1A1 (0.62) HDAC4MEN1KMT2ANPC1ALDH1A1
SCHEMBL17816198 0.80 MEN1 (0.71) HDAC4MEN1KMT2APGRSRC
SCHEMBL7201251 0.79 HDAC4 (0.48) HDAC4MEN1KMT2APGRNPC1

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
US-6605616-B1 Autoimmune diseases; inflammation ACTIVE BIOTECH AB (SE) 2003-08-12 US disclosed