SCHEMBL6079433

SCHEMBL6079433

O=C(Nc1ccc2ccc(S(=O)(=O)O)cc2c1)Nc1ccc2ccc(S(=O)(=O)Nc3ccc(O)c(C(=O)O)c3)cc2c1

nearest known ligand 0.91

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.71
MEN1 O00255 1/20 0.71
KMT2A Q03164 1/20 0.71
PTPN5 P54829 1/20 0.55
TSHR P16473 1/20 0.55
CASP6 P55212 1/20 0.54
KDM4E B2RXH2 1/20 0.52
HPGD P15428 1/20 0.52
HSD17B10 Q99714 1/20 0.52
PRMT1 Q99873 1/20 0.52

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
SCHEMBL6077882 0.95 ALDH1A1 (0.77) ALDH1A1MEN1KMT2APTPN5TSHR
SCHEMBL6079099 0.91 ALDH1A1 (0.58) ALDH1A1MEN1KMT2AHSD17B10PRMT1
SCHEMBL7966502 0.88 ALDH1A1 (0.67) ALDH1A1MEN1KMT2APTPN5TSHR
SCHEMBL6078851 0.86 ALDH1A1 (0.62) ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL6079663 0.85 ALDH1A1 (0.51) ALDH1A1MEN1KMT2APRMT1
SCHEMBL6428822 0.84 PRMT1 (0.56) ALDH1A1PRMT1
SCHEMBL6078378 0.84 PRMT1 (0.61) ALDH1A1MEN1KMT2APTPN5PRMT1
SCHEMBL6079548 0.83 ALDH1A1 (0.59) ALDH1A1MEN1KMT2A
SCHEMBL6078234 0.83 PRMT1 (0.54) ALDH1A1MEN1KMT2APRMT1
SCHEMBL6078356 0.82 MEN1 (0.58) ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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