SCHEMBL6079474

SCHEMBL6079474

COC(=O)c1ccccc1NS(=O)(=O)c1cc(O)c2ccc(NC(=O)Nc3ccc4c(O)cc(S(=O)(=O)Nc5ccccc5C(=O)OC)cc4c3)cc2c1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
GAA P10253 1/20 0.55
PRMT1 Q99873 2/20 0.55
SIRT1 Q96EB6 1/20 0.53
LMNA P02545 4/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
HTT P42858 2/20 0.49
KDM4E B2RXH2 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CRHBP P24387 1/20 0.49
CYP2C19 P33261 1/20 0.49
CRHR2 Q13324 1/20 0.49
NOD2 Q9HC29 1/20 0.49
MAPK1 P28482 3/20 0.47
MAPT P10636 2/20 0.47

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
SCHEMBL6079127 0.88 PRMT1 (0.58) MEN1KMT2AGAAPRMT1SIRT1
SCHEMBL6078794 0.84 MEN1 (0.60) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL6078536 0.82 PRMT1 (0.60) MEN1KMT2AGAAPRMT1SIRT1
SCHEMBL6428056 0.81 PRMT1 (0.58) PRMT1SIRT1KDM4EALDH1A1
SCHEMBL6077709 0.81 TCF4 (0.57) MEN1KMT2APRMT1SIRT1LMNA
SCHEMBL7663909 0.80 PLAU (0.66) MEN1KMT2AGAALMNASMN1; SMN2
SCHEMBL6077806 0.80 PRMT1 (0.54) MEN1KMT2APRMT1SIRT1LMNA
SCHEMBL6078550 0.79 PRMT1 (0.68) MEN1KMT2AGAAPRMT1SIRT1
SCHEMBL6427793 0.79 PRMT1 (0.55) GAAPRMT1SIRT1SMN1; SMN2HTT
SCHEMBL7520951 0.78 TCF4 (0.53) MEN1KMT2APRMT1SIRT1CYP3A4

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