SCHEMBL4449474

SCHEMBL4449474

CC(C)c1nc(Cl)nc(-c2ccc(F)cc2)c1CO

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GCGR P47871 20/20 0.63

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
SCHEMBL27885298 0.88 GCGR (0.49) GCGR
SCHEMBL4455298 0.87 GCGR (0.48) GCGR
SCHEMBL2347107 0.83 GCGR (0.42) GCGR
SCHEMBL4462472 0.81 GCGR (0.48) GCGR
SCHEMBL4453078 0.80 GCGR (0.40) GCGR
SCHEMBL2342322 0.80 GCGR (0.40) GCGR
SCHEMBL2344461 0.80 GCGR (0.40) GCGR
SCHEMBL8949822 0.80 GCGR (0.88) GCGR
SCHEMBL10129522 0.79 GCGR (0.57) GCGR
SCHEMBL945299 0.79 GCGR (0.57) GCGR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009157014-A2 A PROCESS FOR PREPARING HMG-COA REDUCTASE INHIBITORS AND INTERMEDIATES CADILA HEALTHCARE LIMITED (IN) 2009-12-30 WO claimed
CN-104817505-A Method of preparing N-[4-(4-fluorophenyl)-5-hydroxymethyl-6-isopropyl-pyrimidine-2-yl]-N-methylmethanesulfonamide NANJING ABIOCHEM BIOMEDICAL TECHNOLOGY CO LTD 2015-08-05 CN disclosed
WO-2009157014-A2 A PROCESS FOR PREPARING HMG-COA REDUCTASE INHIBITORS AND INTERMEDIATES CADILA HEALTHCARE LIMITED (IN) 2009-12-30 WO disclosed
WO-2009157014-A2 A PROCESS FOR PREPARING HMG-COA REDUCTASE INHIBITORS AND INTERMEDIATES CADILA HEALTHCARE LIMITED (IN) 2009-12-30 WO disclosed