SCHEMBL13128166

SCHEMBL13128166

CO/N=C/c1ccc(OC)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 11/20 0.63
CYP1A1 P04798 9/20 0.63
CYP1B1 Q16678 9/20 0.63
GRIN2D O15399 2/20 0.59
GRIN3B O60391 2/20 0.59
GRIN1 Q05586 2/20 0.59
GRIN2A Q12879 2/20 0.59
GRIN2B Q13224 2/20 0.59
GRIN2C Q14957 2/20 0.59
GRIN3A Q8TCU5 2/20 0.59
ALDH1A1 P00352 4/20 0.59
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
KDM4E B2RXH2 2/20 0.58
AMY1A P0DUB6 1/20 0.58
LMNA P02545 1/20 0.58
GAA P10253 1/20 0.58
HPGD P15428 2/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
NFE2L2 Q16236 2/20 0.56

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
SCHEMBL13128167 0.85 CYP1A1 (0.56) CYP1A2CYP1A1CYP1B1ALDH1A1MEN1
SCHEMBL11747282 0.85 GRIN2D (0.73) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL2009040 0.81 GRIN2D (0.64) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL2009041 0.81 GRIN2D (0.64) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL2316541 0.81 GRIN2D (0.64) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL2314671 0.81 GRIN2D (0.64) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL8237102 0.81 GRIN2D (0.64) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL30481109 0.81 GRIN2D (0.64) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL13044403 0.80 MAPT (0.62) CYP1A2CYP1A1CYP1B1GRIN2DGRIN3B
SCHEMBL14396725 0.80 TRIM24 (0.61) CYP1A2CYP1A1CYP1B1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673932-B2 Oxime substituted imidazo-containing compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-03-18 US disclosed
US-8673932-B2 Oxime substituted imidazo-containing compounds 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-03-18 US disclosed
US-8378102-B2 Oxime and hydroxylamine substituted thiazolo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-19 US disclosed
US-8378102-B2 Oxime and hydroxylamine substituted thiazolo[4,5-c] ring compounds and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-02-19 US disclosed
US-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods COLEY PHARMACEUTICAL GROUP, INC (US) 2010-09-23 US disclosed
US-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods COLEY PHARMACEUTICAL GROUP, INC (US) 2010-09-23 US disclosed
US-20070066639-A1 Oxime substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2007-03-22 US disclosed
US-20070066639-A1 Oxime substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2007-03-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070066639-A1 Oxime substituted imidazoquinolines IFNG, IRF3, IL2 CYP1A2 303/4885CYP1A1 450/4885CYP1B1 716/4885
US-20100240693-A1 Oxime and Hydroxylamine Substituted Thiazolo [4,5-C] Ring Compounds and Methods IL4, IL2, TH CYP1A2 352/4885CYP1A1 497/4885CYP1B1 819/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.