Sugi Predict

Sugi Predict / Compounds / SCHEMBL16758261

SCHEMBL16758261

SCHEMBL16758261

CC(C)(CN1CCC(COc2ccc(-c3ccc(C(=O)[C@@H]4C[C@@H](O)CN4)cc3F)nc2)CC1)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 7/20 0.38
▸ CYP4F2 P78329 9/20 0.37
▸ CYP4A11 Q02928 9/20 0.37
▸ HPGDS O60760 1/20 0.33

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
SCHEMBL16757859 0.92 CYP4F2 (0.36) GPR119CYP4F2CYP4A11HPGDS
SCHEMBL16768907 0.86 GPR119 (0.42) GPR119CYP4F2CYP4A11HPGDS
SCHEMBL16757782 0.84 GPR119 (0.43) GPR119CYP4F2CYP4A11HPGDS
SCHEMBL16758058 0.84 CYP4F2 (0.36) GPR119CYP4F2CYP4A11HPGDS
SCHEMBL16758262 0.84 GPR119 (0.42) GPR119CYP4F2CYP4A11
SCHEMBL16758259 0.84 GPR119 (0.42) GPR119CYP4F2CYP4A11
SCHEMBL16758175 0.83 CYP4F2 (0.36) GPR119CYP4F2CYP4A11HPGDS
SCHEMBL16757793 0.82 GPR119 (0.43) GPR119CYP4F2CYP4A11HPGDS
SCHEMBL16757861 0.81 CNR2 (0.38) GPR119CYP4F2CYP4A11
SCHEMBL18849013 0.81 CNR2 (0.38) GPR119CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3074384-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST Chong Kun Dang Pharmaceutical Corp. (KR) 2016-10-05 — — EP disclosed
WO-2015080446-A1 AMIDE DERIVATIVES FOR GPR119 AGONIST CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2015-06-04 — — WO disclosed