SCHEMBL19975605

SCHEMBL19975605

CCOP(C)(=O)c1cc(C(=O)OCc2ccccc2)cc(CN2CCNCCN(Cc3cc(C(=O)OCc4ccccc4)cc(P(C)(C)=O)n3)CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM5C P41229 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
PRMT1 Q99873 1/20 0.36
PRMT5 O14744 1/20 0.36
CHRM3 P20309 3/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MAPK1 P28482 1/20 0.35
SLC29A1 Q99808 1/20 0.35
JMJD6 Q6NYC1 1/20 0.34
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34
FLT3 P36888 1/20 0.34
KMT2A Q03164 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
SIGMAR1 Q99720 1/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL26886198 0.93 KDM5C (0.36) KDM5CKDM4CPRMT1PRMT5CHRM3
SCHEMBL19975606 0.91 PRMT1 (0.39) PRMT1KDM4EALDH1A1LMNAMAPK1
SCHEMBL19975604 0.86 GPR119 (0.41) KDM4EALDH1A1MAPK1KMT2A
SCHEMBL19975611 0.82 ALDH1A1 (0.34) PRMT1KDM4EALDH1A1LMNASLC29A1
SCHEMBL19975599 0.81 TDP1 (0.43) PRMT1KDM4EALDH1A1LMNAMAPK1
SCHEMBL19975598 0.81 KMT2A (0.45) KDM4EALDH1A1LMNAMAPK1JMJD6
SCHEMBL26885893 0.78 MEN1 (0.35) KDM5CKDM4CKDM4EALDH1A1KMT2A
SCHEMBL19975760 0.78 KDM5C (0.43) KDM5CKDM4CPRMT5CHRM3KDM4E
SCHEMBL19975610 0.78 MAPT (0.35) MAPK1KMT2ASIGMAR1
SCHEMBL19975614 0.77 ITGB3 (0.37) MAPK1SIGMAR1

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-9920082-B2 Water-soluble complexing agents and corresponding lanthanide complexes CISBO BIOASSAYS (FR) 2018-03-20 US disclosed