SCHEMBL6079475

SCHEMBL6079475

O=C(Nc1ccc2c(O)cc(S(=O)(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)cc2c1)Nc1ccc2c(O)cc(S(=O)(=O)Nc3cc(C(=O)O)cc(C(=O)O)c3)cc2c1

nearest known ligand 0.81

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 3/20 0.62
SIRT1 Q96EB6 1/20 0.60
WDR5 P61964 1/20 0.50
CASP6 P55212 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
CYP2C9 P11712 1/20 0.45
ATIC P31939 1/20 0.45
CYP2C19 P33261 1/20 0.45
HSD17B10 Q99714 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL6079091 0.91 PRMT1 (0.64) PRMT1SIRT1CASP6CTDSP1CYP2C9
SCHEMBL6078502 0.90 PRMT1 (0.58) PRMT1SIRT1MEN1KMT2A
SCHEMBL6078494 0.87 PRMT1 (0.73) PRMT1SIRT1CASP6CTDSP1CYP2C9
SCHEMBL6428056 0.87 PRMT1 (0.58) PRMT1SIRT1CASP6CTDSP1
SCHEMBL6078378 0.84 PRMT1 (0.61) PRMT1SIRT1MEN1KMT2A
SCHEMBL6427793 0.84 PRMT1 (0.55) PRMT1SIRT1WDR5CASP6CTDSP1
SCHEMBL6079407 0.83 WDR5 (0.59) WDR5CYP2C9ATICCYP2C19HSD17B10
SCHEMBL7520951 0.83 TCF4 (0.53) PRMT1SIRT1CYP2C9CYP2C19MEN1
SCHEMBL6078120 0.82 CPT2 (0.56) PRMT1SIRT1CASP6CTDSP1
SCHEMBL6079555 0.81 PRMT1 (0.57) PRMT1SIRT1MEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1327635-B1 Preparation of phenylphosphate esters of 4,4'-biphenol BROMINE COMPOUNDS LTD (IL) 2005-08-31 EP claimed
US-7071231-B2 Naphthalene ureas as glucose uptake enhancers TELIK, INC. (US) 2006-07-04 US disclosed
EP-1181271-B1 NAPHTHALENE UREAS AS GLUCOSE UPTAKE ENHANCERS TELIK INC (US) 2005-01-19 EP disclosed
US-6458998-B1 NAPHTHALENEUREAS AS ANTIDIABETIC AGENTS TELIK, INC. 2002-10-01 US disclosed