SCHEMBL17090292

SCHEMBL17090292

Cc1cc(N2C[C@H](C)O[C@H](C)C2C)c(C)cc1NCc1ccc(NS(=O)(=O)C(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
BRD4 O60885 1/20 0.33
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
POLB P06746 1/20 0.31
PARP1 P09874 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
SCHEMBL17090290 0.88 KDM4E (0.38) L3MBTL1BRD4CRHBPCRHR2PARP1
SCHEMBL13565099 0.88 KDM4E (0.38) L3MBTL1BRD4CRHBPCRHR2PARP1
SCHEMBL11941266 0.87 L3MBTL1 (0.33) L3MBTL1BRD4CRHBPCRHR2POLB
SCHEMBL11936097 0.87 L3MBTL1 (0.33) L3MBTL1BRD4CRHBPCRHR2POLB
SCHEMBL17090249 0.87 L3MBTL1 (0.35) L3MBTL1CRHBPCRHR2POLB
SCHEMBL13565938 0.87 L3MBTL1 (0.35) L3MBTL1CRHBPCRHR2POLB
SCHEMBL17090298 0.86 BRD4 (0.35) BRD4
SCHEMBL10116598 0.83 THRB (0.40) CRHBPCRHR2
SCHEMBL10134225 0.83 THRB (0.40) CRHBPCRHR2
SCHEMBL11935962 0.81 POLB (0.33) L3MBTL1POLB

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