SCHEMBL1959983

SCHEMBL1959983

CCOC(=O)/C=C/CCCCO

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.68
ALDH1A1 P00352 2/20 0.60
HCAR2 Q8TDS4 1/20 0.48
FAAH O00519 2/20 0.41
CYP4F2 P78329 2/20 0.41
CYP4A11 Q02928 2/20 0.41
CYP3A4 P08684 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ATM Q13315 1/20 0.39
TTR P02766 1/20 0.39
DPP4 P27487 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39

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
SCHEMBL1959985 1.00 MAPT (0.68) MAPTALDH1A1HCAR2FAAHCYP4F2
SCHEMBL27925927 0.98 MAPT (0.66) MAPTALDH1A1HCAR2FAAHCYP4F2
SCHEMBL10015549 0.98 MAPT (0.66) MAPTALDH1A1HCAR2FAAHCYP4F2
SCHEMBL29131601 0.94 MAPT (0.70) MAPTALDH1A1HCAR2FAAHCYP4F2
SCHEMBL17679310 0.94 MAPT (0.70) MAPTALDH1A1HCAR2FAAHCYP4F2
SCHEMBL22100454 0.88 MAPT (0.85) MAPTALDH1A1HCAR2FAAHCYP3A4
SCHEMBL27487508 0.86 MAPT (0.70) MAPTALDH1A1HCAR2FAAHALOX15
SCHEMBL872985 0.86 MAPT (0.70) MAPTALDH1A1HCAR2FAAHALOX15
SCHEMBL872986 0.86 MAPT (0.70) MAPTALDH1A1HCAR2FAAHALOX15
SCHEMBL28309024 0.86 MAPT (0.51) MAPTALDH1A1HCAR2FAAHCYP4F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2513103-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. Hoffmann-La Roche AG (CH) 2012-10-24 EP disclosed
US-8222416-B2 Azaindole glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2012-07-17 US disclosed
WO-2011073117-A1 AZAINDOLE GLUCOKINASE ACTIVATORS F. HOFFMANN-LA ROCHE AG (CH) 2011-06-23 WO disclosed
US-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2011-06-16 US disclosed
EP-2217589-A2 MODULATORS OF OCULAR OXIDATIVE STRESS ReVision Therapeutics, Inc. (US) 2010-08-18 EP disclosed
US-20090253745-A1 MODULATORS OF OCULAR OXIDATIVE STRESS SIRION THERAPEUTICS, INC. (US) 2009-10-08 US disclosed
WO-2009070693-A2 MODULATORS OF OCULAR OXIDATIVE STRESS SIRION THERAPEUTICS, INC (US) 2009-06-04 WO 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-20090253745-A1 MODULATORS OF OCULAR OXIDATIVE STRESS GPX4, GPX1, ALDH1A2 MAPT 2604/4885ALDH1A1 235/4885HCAR2 1193/4885
US-20110144105-A1 AZAINDOLE GLUCOKINASE ACTIVATORS GCK, GCKR, GALK1 MAPT 4347/4885ALDH1A1 769/4885HCAR2 1813/4885

“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.