SCHEMBL6089230

SCHEMBL6089230

CCc1c(C(=O)c2cc(C)cc(C)c2)n(Cc2cc(Br)cc(Br)c2)c(=O)[nH]c1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.38
HDAC1 Q13547 3/20 0.36
HDAC8 Q9BY41 3/20 0.36
HDAC6 Q9UBN7 3/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
TPH1 P17752 1/20 0.34
TPH2 Q8IWU9 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
MAPT P10636 1/20 0.32
ALOX12 P18054 1/20 0.32
MAPK1 P28482 1/20 0.32
BRAF P15056 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6089500 0.92 TPH1 (0.38) HDAC1HDAC8HDAC6MEN1KMT2A
SCHEMBL6086074 0.89 MEN1 (0.35) HDAC8HDAC6MEN1KMT2ATDP1
SCHEMBL6086116 0.86 GRIN1 (0.37) HDAC1HDAC8HDAC6MEN1KMT2A
SCHEMBL6087483 0.86 MEN1 (0.43) MEN1KMT2AMAPK1HPGDTSHR
SCHEMBL6085624 0.84 TYMS (0.36) TYMSHDAC1HDAC8HDAC6MEN1
SCHEMBL6086765 0.84 MEN1 (0.38) MEN1KMT2ATDP1SMN1; SMN2MAPT
SCHEMBL6086524 0.84 HDAC1 (0.39) HDAC1HDAC8HDAC6MEN1KMT2A
SCHEMBL7844325 0.83 TYMS (0.35) TYMSHDAC1HDAC8HDAC6MEN1
SCHEMBL12752168 0.83 KMT2A (0.40) MEN1KMT2ATDP1TPH1TPH2
SCHEMBL6087754 0.81 KMT2A (0.39) MEN1KMT2ATDP1SMN1; SMN2MAPT

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-6987114-B1 Antiviral pyrimidinedione derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD (KR) 2006-01-17 US disclosed