SCHEMBL8310061

SCHEMBL8310061

Cc1nc(-c2ccccc2)n(C)c1C=NOCCO

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TARBP2 Q15633 1/20 0.34
P2RX7 Q99572 3/20 0.34
ALDH1A1 P00352 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
GABRA2 P47869 1/20 0.34
GABRB2 P47870 1/20 0.34
HPGD P15428 2/20 0.33
CYP1A2 P05177 1/20 0.33
GSK3B P49841 3/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
ATM Q13315 1/20 0.33
KDM4E B2RXH2 2/20 0.32
PDE7A Q13946 1/20 0.32
PDE7B Q9NP56 1/20 0.32
DHODH Q02127 1/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL8310056 1.00 TARBP2 (0.34) TARBP2P2RX7ALDH1A1NPSR1GABRA2
SCHEMBL8307910 0.78 KDM4E (0.47) P2RX7ALDH1A1CYP1A2ATMKDM4E
SCHEMBL8307908 0.78 KDM4E (0.47) P2RX7ALDH1A1CYP1A2ATMKDM4E
SCHEMBL8307017 0.76 KDM4C (0.39) KDM4ENPC1MAPTRAB9A
SCHEMBL8689516 0.73 KDM4E (0.39) ALDH1A1HPGDCYP1A2KDM4ELMNA
SCHEMBL8304602 0.73 PPARG (0.55) PPARGPPARA
SCHEMBL8304608 0.73 PPARG (0.55) PPARGPPARA
SCHEMBL8689523 0.72 POLB (0.36) ALDH1A1NPSR1HPGDKDM4ENPC1
SCHEMBL8308913 0.68 HDAC2 (0.54) ALDH1A1CYP1A2HDAC1HDAC2ATM
SCHEMBL8308910 0.68 HDAC2 (0.54) ALDH1A1CYP1A2HDAC1HDAC2ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5972959-A Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY, LIMITED (JP) 1999-10-26 US disclosed
EP-0708098-B1 Oxime derivatives, their preparation and their therapeutic use SANKYO CO (JP) 1999-03-03 EP disclosed
US-5780490-A A O-(2,4-OXA(OR THIA)ZOLIDINYL)PHENYLOXY(OR THIO OR AMINO) ALKYLOXIME; ALDOSE REDUCTASE INHIBITORS; ANTIDIABETIC AND -HYPOGLYCEMIC AGENTS; LIVER, SKIN AND UROGENITAL DISORDERS SANKYO COMPANY, LIMITED (JP) 1998-07-14 US disclosed
US-5703096-A ANTIDIABETIC AGENTS; ALDOSE REDUCTASE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1997-12-30 US disclosed
EP-0708098-A1 Oxime derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1996-04-24 EP disclosed