SCHEMBL17090286

SCHEMBL17090286

Cc1cc(N2C[C@@H](C)O[C@@H](C)C2)c(C)cc1NCc1ccc(NS(=O)(=O)C(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CRHBP P24387 2/20 0.34
CRHR2 Q13324 2/20 0.34
ADRB3 P13945 2/20 0.33
MAPT P10636 2/20 0.33
KIF18A Q8NI77 1/20 0.33
HSD11B1 P28845 3/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL13566037 1.00 KDM4E (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL13565533 0.89 KDM4E (0.40) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL17090249 0.88 L3MBTL1 (0.35) L3MBTL1CRHBPCRHR2ADRB3HSD11B1
SCHEMBL13565938 0.88 L3MBTL1 (0.35) L3MBTL1CRHBPCRHR2ADRB3HSD11B1
SCHEMBL13565668 0.86 L3MBTL1 (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL17090290 0.86 KDM4E (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL13565099 0.86 KDM4E (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL13566082 0.86 KDM4E (0.40) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL17090554 0.86 KDM4E (0.40) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL17090447 0.84 KMT2A (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2

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-9139518-B2 Amine derivative having NPY Y5 receptor antagonistic activity SHIONOGI & CO., LTD. (JP) 2015-09-22 US disclosed