SCHEMBL7770832

SCHEMBL7770832

CC(C)OC(=O)NC(C)(C)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.36
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
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
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
SCHEMBL25848572 0.81 KDM4C (0.38) MAPTTSHRHPGDHTTNPC1
SCHEMBL7770827 0.79 TSHR (0.36) MAPTTSHRHPGDHTTNPC1
SCHEMBL4783072 0.78 ALDH1A1 (0.30) ALDH1A1
SCHEMBL7808415 0.78 TSHR (0.42) MAPTTSHRHPGDHTTNPC1
SCHEMBL21916197 0.75 MAPT (0.40) MAPTTSHRHPGDHTTNPC1
SCHEMBL2190730 0.74 MAOA (0.40) KDM4E
SCHEMBL20908068 0.73 MAPT (0.42) MAPTTSHRHPGDHTTNPC1
SCHEMBL14864523 0.73 MAPT (0.42) MAPTTSHRHPGDHTTNPC1
SCHEMBL13570702 0.71 POLB (0.31)
SCHEMBL20907637 0.71 TSHR (0.36) MAPTTSHRHPGDHTTNPC1

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