SCHEMBL20375412

SCHEMBL20375412

CSN1CCC(Oc2ncnc(OC3CCN(C(=O)c4ccc(F)cc4)CC3)c2C)CC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 5/20 0.46
▸ HSD11B1 P28845 4/20 0.46
▸ MAPK7 Q13164 1/20 0.45
▸ ADRB2 P07550 1/20 0.44
▸ PIK3CD O00329 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ HTR2B P41595 1/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ PAK1 Q13153 1/20 0.42
▸ LSS P48449 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
SCHEMBL20375636 0.90 MGLL (0.46) GPR119HSD11B1PIK3CDALDH1A1LMNA
SCHEMBL12236474 0.86 GPR119 (0.48) GPR119HSD11B1MAPK7ADRB2PIK3CD
SCHEMBL12236417 0.84 GPR119 (0.51) GPR119HSD11B1MAPK7CYP2C9
SCHEMBL20375627 0.80 RBP4 (0.55) GPR119PIK3CDL3MBTL1
SCHEMBL20375645 0.79 GPR119 (0.55) GPR119PIK3CDCYP2C9
SCHEMBL20375405 0.78 GPR119 (0.56) GPR119PIK3CD
SCHEMBL12236539 0.76 GPR119 (0.49) GPR119MAPK7PIK3CDCYP2C9MEN1
SCHEMBL12236481 0.76 MGLL (0.46) GPR119PIK3CDPOLBMEN1KMT2A
SCHEMBL12236480 0.76 MAPK7 (0.48) GPR119HSD11B1MAPK7ADRB2PIK3CD
SCHEMBL3810600 0.76 GPR119 (0.44) GPR119CYP2C9

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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