SCHEMBL300994

SCHEMBL300994

CCOC(=O)[C@H](C)O[C@@H](C)c1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.47
CA12 O43570 4/20 0.47
CA1 P00915 4/20 0.47
CA2 P00918 4/20 0.47
CA7 P43166 4/20 0.47
CA9 Q16790 4/20 0.47
CA14 Q9ULX7 4/20 0.47
ESR2 Q92731 3/20 0.47
LMNA P02545 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 2/20 0.40
ALDH2 P05091 1/20 0.40
CYP1A2 P05177 1/20 0.40
PGR P06401 1/20 0.40
CHRM2 P08172 1/20 0.40
CYP3A4 P08684 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
AR P10275 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL2098150 1.00 ESR1 (0.47) ESR1CA12CA1CA2CA7
SCHEMBL1823023 1.00 ESR1 (0.47) ESR1CA12CA1CA2CA7
SCHEMBL3426571 0.88 KMT2A (0.43) LMNAL3MBTL1KMT2ATDP1KDM4E
SCHEMBL2720024 0.85 LMNA (0.38) LMNAL3MBTL1KMT2AOPRM1TDP1
SCHEMBL16673423 0.85 MMP8 (0.51) LMNAL3MBTL1KMT2ACYP1A2CYP3A4
SCHEMBL1823024 0.84 ESR1 (0.38) ESR1CA12CA1CA2CA7
SCHEMBL11307651 0.81 MAPT (0.50) CA12CA1CA2CA9LMNA
SCHEMBL2784263 0.79 ESR1 (0.45) ESR1CA12CA1CA2CA7
SCHEMBL2783556 0.79 ESR1 (0.45) ESR1CA12CA1CA2CA7
SCHEMBL9235662 0.79 ESR1 (0.53) ESR1CA12CA1CA2CA7

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-2315739-B1 NEW PROPANOATES AND PROCESSES FOR PREPARING THE SAME DUPONT ELECTRONIC POLYMERS L P (US) 2014-11-12 EP claimed
US-8163464-B2 Propanoates and processes for preparing the same Du Pont Electronic Polymers L.P. (US) 2012-04-24 US claimed
JP-2012500846-A 2012-01-12 JP claimed
EP-2315739-A1 NEW PROPANOATES AND PROCESSES FOR PREPARING THE SAME DuPont Electronic Polymers L.P. (US) 2011-05-04 EP claimed
US-8163464-B2 Propanoates and processes for preparing the same Du Pont Electronic Polymers L.P. (US) 2012-04-24 US disclosed
WO-2010024841-A1 NEW PROPANOATES AND PROCESSES FOR PREPARING THE SAME DUPONT ELECTRONIC POLYMERS L.P. (US) 2010-03-04 WO disclosed
US-20100047714-A1 New propanoates and processes for preparing the same U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2010-02-25 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 (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-20100047714-A1 New propanoates and processes for preparing the same HPD, HMBS, LDHB ESR1 1760/4885CA12 2635/4885CA1 3643/4885

“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.