SCHEMBL7770827

SCHEMBL7770827

CC(C)OC(=O)NC(C)(C)C([NH])=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
MAPT P10636 1/20 0.34
HPGD P15428 2/20 0.33
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
ALOX15 P16050 1/20 0.31
KCNJ11 Q14654 1/20 0.31
CTSK P43235 1/20 0.30

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
SCHEMBL7770832 0.79 MAPT (0.37) TSHRMAPTHPGDHTTNPC1
SCHEMBL7770065 0.78 ALDH1A1 (0.30) ALDH1A1
SCHEMBL7808415 0.78 TSHR (0.42) TSHRMAPTHPGDHTTNPC1
SCHEMBL7771576 0.74 TDP1 (0.37) CTSK
SCHEMBL7773591 0.71 GAA (0.39) TSHRHTTNPC1CYP1A2CYP2C9
SCHEMBL19509436 0.71 MAPT (0.37) TSHRMAPTHPGDHTTNPC1
SCHEMBL20907637 0.71 TSHR (0.36) TSHRMAPTHPGDHTTNPC1
SCHEMBL20908067 0.71 ALDH1A1 (0.36) TSHRMAPTHPGDHTTNPC1
SCHEMBL20908068 0.69 MAPT (0.42) TSHRMAPTHPGDHTTNPC1
SCHEMBL22539526 0.69 HPGD (0.36) TSHRMAPTHPGDHTTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed