SCHEMBL4739612

SCHEMBL4739612

CCOC(=O)c1cc(Cl)c(O)nc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.55
HSD17B10 Q99714 3/20 0.54
ALDH1A1 P00352 4/20 0.52
MAPT P10636 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ALOX15 P16050 1/20 0.51
GAA P10253 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TSHR P16473 2/20 0.50
HPGD P15428 3/20 0.49
CYP4F2 P78329 1/20 0.47
CYP4A11 Q02928 1/20 0.47
BAZ2B Q9UIF8 1/20 0.47
BAZ2A Q9UIF9 1/20 0.47
ACHE P22303 2/20 0.45
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45

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
SCHEMBL4737125 0.85 KDM4E (0.56) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL4738002 0.83 GAA (0.51) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL10468309 0.82 KDM4E (0.47) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL10469479 0.81 KDM4E (0.43) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL2301745 0.81 KDM4E (0.77) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL2929292 0.81 KDM4E (0.55) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL2016630 0.81 KDM4E (0.55) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL16616673 0.80 KDM4E (0.72) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL10467502 0.79 KDM4E (0.49) KDM4EHSD17B10ALDH1A1MAPTTDP1
SCHEMBL236240 0.79 CYP4F2 (0.57) KDM4EHSD17B10ALDH1A1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200448-A1 reversible and selective purinergic receptor P2Y12 antagonists; anticoagulants; cardiovascular disorders; e.g. ethyl 2-acetoxy-6-{4-[(benzylsulfonyl)carbamoyl]piperidin-1-yl}-5-cyanonicotinate ASTRAZENECA AB (SE) 2008-08-21 US disclosed
WO-2008085119-A1 NEW PYRIDINE ANALOGUES VIII 518 ASTRAZENECA AB (SE) 2008-07-17 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 (1 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-20080200448-A1 reversible and selective purinergic receptor P2Y12 antagonists; anticoagulants; cardiovascular disorders; e.g. ethyl 2-acetoxy-6-{4-[(benzylsulfonyl)carbamoyl]piperidin-1-yl}-5-cyanonicotinate P2RY12, P2RY13, P2RY11 KDM4E 2864/4885HSD17B10 4541/4885ALDH1A1 2394/4885

“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.