SCHEMBL20375627

SCHEMBL20375627

CSN1CCC(Oc2ncnc(OC3CCN(C(=O)c4ccccn4)CC3)c2C)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RBP4 P02753 1/20 0.55
▸ PIK3CD O00329 1/20 0.49
▸ GPR119 Q8TDV5 4/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ EPHX2 P34913 1/20 0.44
▸ KDM5A P29375 1/20 0.43
▸ PDE4B Q07343 1/20 0.43
▸ RIPK1 Q13546 1/20 0.42

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
SCHEMBL12236475 0.87 RBP4 (0.56) RBP4PIK3CDGPR119L3MBTL1EPHX2
SCHEMBL12236420 0.85 RBP4 (0.54) RBP4PIK3CDGPR119L3MBTL1
SCHEMBL20375636 0.80 MGLL (0.46) PIK3CDGPR119
SCHEMBL20375412 0.80 GPR119 (0.46) PIK3CDGPR119L3MBTL1
SCHEMBL20375645 0.78 GPR119 (0.55) PIK3CDGPR119
SCHEMBL20375405 0.77 GPR119 (0.56) PIK3CDGPR119
SCHEMBL3811986 0.75 GPR119 (0.47) RBP4PIK3CDGPR119EPHX2
SCHEMBL3811989 0.75 GPR119 (0.47) RBP4PIK3CDGPR119EPHX2
SCHEMBL3811526 0.74 GPR119 (0.46) RBP4PIK3CDGPR119
SCHEMBL3811530 0.74 GPR119 (0.46) RBP4PIK3CDGPR119

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
EP-2382204-B1 PYRIMIDINE DERIVATIVES AS GPCR MODULATORS FOR USE IN THE TREATMENT OF OBESITY AND DIABETES MERCK SHARP & DOHME (US) 2018-07-11 — — EP disclosed
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