SCHEMBL7056716

SCHEMBL7056716

Cc1c(N)cn(C)c1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 1/20 0.36
GPR35 Q9HC97 1/20 0.35
NOTUM Q6P988 1/20 0.30

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
SCHEMBL5154729 0.81 KDM4E (0.31) KDM4EMEN1KMT2ATDP1
SCHEMBL2215301 0.79 MMP2 (0.35) KDM4EMEN1KMT2ATDP1
SCHEMBL28782535 0.78 GPR35 (0.37) KDM4EMEN1KMT2ATDP1USP2
SCHEMBL7253526 0.77 NOTUM (0.40) KDM4EMEN1KMT2ATDP1USP2
SCHEMBL31454221 0.75 GPR35 (0.35) USP2GPR35NOTUM
SCHEMBL1254374 0.75 GPR35 (0.46) MEN1KMT2AUSP2GPR35NOTUM
SCHEMBL22890300 0.71 GRIA4 (0.38) KDM4E
SCHEMBL5154621 0.70 SELL (0.34) KDM4ETDP1GPR35
SCHEMBL19332519 0.69 TSHR (0.45) MEN1KMT2ATDP1GPR35
SCHEMBL1254367 0.69 BRD4 (0.47) KDM4EMEN1KMT2A

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-2003020877-A2 STAINING AND SORTING GENOMES AND CHROMOSOMES USING SEQUENCE-SPECIFIC POLYAMIDES PHARMACIA CORPORATION (US) 2003-03-13 WO disclosed