SCHEMBL21248918

SCHEMBL21248918

CC(C)(C)OC(=O)N1CC(CCCNC(=O)OCc2ccccc2)C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.53
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.50
NAMPT P43490 1/20 0.49
KEAP1 Q14145 4/20 0.48
NFE2L2 Q16236 4/20 0.48
ITGB3 P05106 1/20 0.48
ITGA2B P08514 1/20 0.48
KLK7 P49862 2/20 0.48
KLK5 Q9Y337 2/20 0.48
DPP8 Q6V1X1 2/20 0.48
DPP7 Q9UHL4 2/20 0.48
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
TGM2 P21980 1/20 0.46
DPP4 P27487 1/20 0.45
DPP9 Q86TI2 1/20 0.45
PREP P48147 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44

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
SCHEMBL24392263 0.94 NAMPT (0.51) ABCB1MAPTHTTNAMPTKEAP1
SCHEMBL20659982 0.91 KDM4E (0.56) ABCB1HTTKEAP1NFE2L2ITGB3
SCHEMBL2826301 0.87 NAMPT (0.61) ABCB1MAPTHTTNAMPTLMNA
SCHEMBL19063606 0.85 KDM4E (0.53) ABCB1HTTKEAP1NFE2L2ITGB3
SCHEMBL30990345 0.85 KDM4E (0.53) ABCB1HTTKEAP1NFE2L2ITGB3
SCHEMBL28765289 0.85 ABCB1 (0.49) ABCB1MAPTHTTKEAP1NFE2L2
SCHEMBL26939035 0.85 ABCB1 (0.49) ABCB1MAPTHTTKEAP1NFE2L2
SCHEMBL29130086 0.85 ABCB1 (0.57) ABCB1MAPTHTTKEAP1NFE2L2
SCHEMBL19063610 0.84 ABCB1 (0.48) ABCB1MAPTHTTNAMPTKEAP1
SCHEMBL19063614 0.84 ABCB1 (0.48) ABCB1MAPTHTTNAMPTKEAP1

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-3752498-A1 SOMATOSTATIN MODULATORS AND USES THEREOF Crinetics Pharmaceuticals, Inc. (US) 2020-12-23 EP disclosed
WO-2019157458-A1 SOMATOSTATIN MODULATORS AND USES THEREOF Crinetics Pharmaceuticals, Inc. (US) 2019-08-15 WO disclosed