SCHEMBL16293104

SCHEMBL16293104

CN(C)CC=CCN(Cc1cc(CO[Si](C)(C)C(C)(C)C)ccn1)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 1/20 0.35
▸ BACE1 P56817 1/20 0.32
▸ LNPEP Q9UIQ6 1/20 0.31
▸ HTR2C P28335 2/20 0.31
▸ SLC6A4 P31645 2/20 0.31
▸ HDAC3 O15379 1/20 0.31
▸ HDAC1 Q13547 1/20 0.31
▸ HDAC2 Q92769 1/20 0.31
▸ NCOR2 Q9Y618 1/20 0.31

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
SCHEMBL15994296 1.00 SSTR4 (0.35) SSTR4BACE1LNPEPHTR2CSLC6A4
SCHEMBL16293117 0.90 LNPEP (0.34) BACE1LNPEP
SCHEMBL16293114 0.90 LNPEP (0.34) BACE1LNPEP
SCHEMBL15994292 0.85 SSTR4 (0.40) SSTR4LNPEPHTR2CSLC6A4HDAC3
SCHEMBL15996211 0.85 SSTR4 (0.40) SSTR4LNPEPHTR2CSLC6A4HDAC3
SCHEMBL16293333 0.85 SSTR4 (0.40) SSTR4LNPEPHTR2CSLC6A4HDAC3
SCHEMBL15994139 0.80 SSTR4 (0.38) SSTR4HDAC3HDAC1HDAC2NCOR2
SCHEMBL15994207 0.80 SSTR4 (0.38) SSTR4HTR2CSLC6A4
SCHEMBL15994206 0.80 SSTR4 (0.38) SSTR4HTR2CSLC6A4
SCHEMBL15994186 0.80 SSTR4 (0.38) SSTR4HTR2CSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2961736-B1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES INC (US) 2018-04-11 — — EP disclosed
EP-3170811-A1 ETHYL PYRIDINE-4-CARBOXYLATE COMPOUND AS INHIBITOR OF HISTONE DEMETHYLASES Gilead Sciences, Inc. (US) 2017-05-24 — — EP disclosed
US-9650339-B2 Inhibitors of histone demethylases GILEAD SCIENCES, INC. (US) 2017-05-16 — — US disclosed
US-20160237037-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2016-08-18 — — US disclosed
US-9221801-B2 Inhibitors of histone demethylases EPITHERAPEUTICS APS (DK) 2015-12-29 — — US disclosed
US-20140371214-A1 INHIBITORS OF HISTONE DEMETHYLASES GILEAD SCIENCES, INC. 2014-12-18 — — 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 (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-20140371214-A1 INHIBITORS OF HISTONE DEMETHYLASES KDM1B, KDM1A, KDM3A SSTR4 4865/4885BACE1 3110/4885LNPEP 2933/4885
US-20160237037-A1 INHIBITORS OF HISTONE DEMETHYLASES KDM1B, KDM1A, KDM3A SSTR4 4865/4885BACE1 3110/4885LNPEP 2933/4885

“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.

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