SCHEMBL3971814

SCHEMBL3971814

O=C1OC2(CCNC2)c2c(C(=O)C3(c4ccnc5ccccc45)CC3)cnc(O)c21

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SSTR1 P30872 1/20 0.31
SSTR2 P30874 1/20 0.31
SSTR4 P31391 1/20 0.31
SSTR3 P32745 1/20 0.31
SSTR5 P35346 1/20 0.31
REN P00797 1/20 0.30
CYP3A4 P08684 1/20 0.30
KCNH2 Q12809 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
SCHEMBL3973749 0.88 ALDH1A1 (0.31) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL349869 0.68 HSD11B1 (0.51)
SCHEMBL3976955 0.66 NPY5R (0.35) CYP3A4
SCHEMBL350775 0.64 SLC22A12 (0.52)
SCHEMBL31446701 0.64 SLC22A12 (0.52)
SCHEMBL3910622 0.64 HSD11B1 (0.37)
SCHEMBL4078060 0.64 NPY5R (0.34)
SCHEMBL3970810 0.64 AKT1 (0.32)
SCHEMBL3900058 0.64 SLC6A2 (0.33) CYP3A4
SCHEMBL3903174 0.64 HSD11B1 (0.32)

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
EP-1756063-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-03-25 EP claimed
EP-1756063-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-02-28 EP claimed
WO-2005110992-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2005-11-24 WO claimed