SCHEMBL7950190

SCHEMBL7950190

CCOC(=O)C1Cc2ccccc2CC(C(=O)OCC)C1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
GAA P10253 2/20 0.58
KDM4E B2RXH2 2/20 0.58
MAPT P10636 2/20 0.58
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
HSD17B10 Q99714 1/20 0.58
RAB9A P51151 1/20 0.50
NR1D1 P20393 4/20 0.45
TSHR P16473 2/20 0.44
PPARG P37231 1/20 0.44
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
ATM Q13315 1/20 0.42
CHRM2 P08172 1/20 0.42
CHRM4 P08173 1/20 0.42
CHRM5 P08912 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42

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
SCHEMBL490810 0.83 MAPT (0.70) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL31460799 0.83 MAPT (0.70) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL13520076 0.82 PPARG (0.60) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL2062381 0.82 MTNR1A (0.47) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL2061479 0.81 ALDH1A1 (0.52) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL30047263 0.81 ALDH1A1 (0.52) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL4815395 0.81 NR1D1 (0.48) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL259951 0.81 ALDH1A1 (0.52) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL14193309 0.81 NR1D1 (0.48) MEN1KMT2AGAAKDM4EMAPT
SCHEMBL468628 0.81 KMT2A (0.40) MEN1KMT2AHSD17B10TSHRMAPK1

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-8921359-B2 Inhibitors of beta-secretase VITAE PHARMACEUTICALS, INC. (US) 2014-12-30 US disclosed
US-8921359-B2 Inhibitors of beta-secretase VITAE PHARMACEUTICALS, INC. (US) 2014-12-30 US disclosed
EP-2324032-B1 INHIBITORS OF BETA-SECRETASE VITAE PHARMACEUTICALS INC (US) 2014-10-01 EP disclosed
US-8450308-B2 Inhibitors of beta-secretase VITAE PHARMACEUTICALS, INC. (US) 2013-05-28 US disclosed
US-8450308-B2 Inhibitors of beta-secretase VITAE PHARMACEUTICALS, INC. (US) 2013-05-28 US disclosed
US-20110218192-A1 Inhibitors Of Beta-Secretase VITAE PHARMACEUTICALS, INC. (US) 2011-09-08 US disclosed
US-20110218192-A1 Inhibitors Of Beta-Secretase VITAE PHARMACEUTICALS, INC. (US) 2011-09-08 US disclosed
WO-2010021680-A2 INHIBITORS OF BETA-SECRETASE VITAE PHARMACEUTICALS, INC. (US) 2010-02-25 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-20110218192-A1 Inhibitors Of Beta-Secretase BACE1, BACE2, APP MEN1 813/4885KMT2A 3252/4885GAA 39/4885

“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.