SCHEMBL17090290

SCHEMBL17090290

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

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
BRD4 O60885 1/20 0.35
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BRPF1 P55201 1/20 0.33
PARP1 P09874 1/20 0.32
HTT P42858 1/20 0.32
HSD11B1 P28845 2/20 0.32
PPARA Q07869 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
SCHEMBL13565099 1.00 KDM4E (0.38) KDM4ELMNAL3MBTL1BRD4CRHBP
SCHEMBL13565888 0.89 KDM4E (0.40) KDM4ELMNAL3MBTL1BRD4CRHBP
SCHEMBL17090292 0.88 L3MBTL1 (0.33) L3MBTL1BRD4CRHBPCRHR2PARP1
SCHEMBL13565508 0.86 MAPT (0.37) KDM4ELMNAL3MBTL1BRD4CRHBP
SCHEMBL13565361 0.86 MAPT (0.37) KDM4ELMNAL3MBTL1BRD4CRHBP
SCHEMBL17090286 0.86 KDM4E (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL13566018 0.86 KDM4E (0.40) KDM4ELMNAL3MBTL1BRD4CRHBP
SCHEMBL13566037 0.86 KDM4E (0.38) KDM4ELMNAL3MBTL1CRHBPCRHR2
SCHEMBL13565266 0.86 KDM4E (0.40) KDM4ELMNAL3MBTL1BRD4CRHBP
SCHEMBL13564991 0.86 KDM4E (0.40) KDM4ELMNAL3MBTL1BRD4CRHBP

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