SCHEMBL2598519

SCHEMBL2598519

CCSC(=O)C(OCc1ccccc1)[C@H]1OC(C)(C)OC1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 2/20 0.35
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
IDO1 P14902 2/20 0.34
PSMB5 P28074 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
CETP P11597 3/20 0.31
ELANE P08246 2/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
GSTP1 P09211 1/20 0.31

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
SCHEMBL2598522 0.86 SLC1A3 (0.43) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598530 0.86 SLC1A3 (0.43) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598549 0.84 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598554 0.82 IDO1 (0.37) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598551 0.82 IDO1 (0.37) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598523 0.80 IDO1 (0.36) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598442 0.74 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL2598446 0.74 SLC1A3 (0.37) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL18302853 0.73 SLC1A1 (0.41) SLC1A3SLC1A2SLC1A1MEN1CYP1A2
SCHEMBL18302851 0.73 SLC1A1 (0.41) SLC1A3SLC1A2SLC1A1MEN1CYP1A2

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-2571864-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS Array Biopharma, Inc. (US) 2013-03-27 EP disclosed
WO-2011146335-A1 PIPERIDINYL-SUBSTITUTED LACTAMS AS GPR119 MODULATORS ARRAY BIOPHARMA INC. (US) 2011-11-24 WO disclosed