SCHEMBL2894343

SCHEMBL2894343

CC(C)(C)OC(=O)N1CCCCC1/C=N\O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.42
HPGD P15428 1/20 0.41
EPHX1 P07099 1/20 0.40
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
PREP P48147 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.37
PDE8B O95263 1/20 0.36

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
SCHEMBL8228189 1.00 HSD17B10 (0.42) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL8220765 1.00 HSD17B10 (0.42) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL2897865 1.00 HSD17B10 (0.42) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL2897864 1.00 HSD17B10 (0.42) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL2894345 1.00 HSD17B10 (0.42) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL2893902 0.95 HSD17B10 (0.46) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL4561004 0.95 HSD17B10 (0.46) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL2893904 0.95 HSD17B10 (0.46) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL8228626 0.95 HSD17B10 (0.46) HSD17B10HPGDEPHX1LMNANPSR1
SCHEMBL2893906 0.95 HSD17B10 (0.46) HSD17B10HPGDEPHX1LMNANPSR1

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
EP-1879884-B1 AZOLE-BASED PHOSPHODIESTERASE INHIBITORS RANBAXY LAB LTD (IN) 2010-08-25 EP disclosed
US-7678796-B2 MGluR5 modulators I ASTRAZENECA AB (SE) 2010-03-16 US disclosed
US-20070259916-A1 mGluR5 modulators II ASTRAZENECA AB (SE) 2007-11-08 US disclosed
US-20070185100-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB (SE) 2007-08-09 US disclosed
US-20060025414-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists ASTRAZENECA AB 2006-02-02 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 (3 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-20070259916-A1 mGluR5 modulators II GRM5, GRM2, GRIK5 HSD17B10 2632/4885HPGD 2431/4885EPHX1 2426/4885
US-20060025414-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists GRM3, GRM1, GRM4 HSD17B10 4239/4885HPGD 1467/4885EPHX1 1913/4885
US-20070185100-A1 Poly-heterocyclic compounds and their use as metabotropic glutamate receptor antagonists GRM3, GRM1, GRM4 HSD17B10 4130/4885HPGD 1396/4885EPHX1 1948/4885

“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.