SCHEMBL28601507

SCHEMBL28601507

NC(=O)O[C@@H]1CCN(c2ccc(C(F)(F)F)cc2Cl)C1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 15/20 0.52
▸ LPL P06858 4/20 0.52
▸ LIPC P11150 5/20 0.51
▸ GPR119 Q8TDV5 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.47
▸ CYP2C9 P11712 2/20 0.47
▸ CYP2C19 P33261 2/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ GAA P10253 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46

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
SCHEMBL28601509 1.00 LIPG (0.52) LIPGLPLLIPCGPR119KDM4E
SCHEMBL28601654 0.93 LMNA (0.46) LIPGLPLLIPCGPR119KDM4E
SCHEMBL28601649 0.93 LMNA (0.46) LIPGLPLLIPCGPR119KDM4E
SCHEMBL28593872 0.88 LIPG (0.53) LIPGLPLLIPCCYP2C9CYP2C19
SCHEMBL28593878 0.88 LIPG (0.53) LIPGLPLLIPCCYP2C9CYP2C19
SCHEMBL28595539 0.83 LIPG (0.49) LIPGLPLLIPCGPR119KDM4E
SCHEMBL21624699 0.81 NOTUM (0.59) LIPGLPLLIPCGPR119KDM4E
SCHEMBL21624697 0.81 NOTUM (0.59) LIPGLPLLIPCGPR119KDM4E
SCHEMBL22499786 0.80 NOTUM (0.62) KDM4ECYP2C9CYP2C19ALDH1A1HPGD
SCHEMBL22499789 0.80 NOTUM (0.62) KDM4ECYP2C9CYP2C19ALDH1A1HPGD

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
CN-113164461-A Heterocyclic derivatives as Nav1.7 and Nav1.8 blockers 拉夸里亚创药株式会社 2021-07-23 — — CN disclosed
Send feedback