SCHEMBL908629

SCHEMBL908629

COCOC(CCO)C(C(=O)NNC(=O)OC(C)(C)C)c1cc(F)c(F)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.37
GAA P10253 2/20 0.32
ALDH1A1 P00352 1/20 0.32
ANPEP P15144 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 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
SCHEMBL14693930 1.00 APLNR (0.37) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL908631 1.00 APLNR (0.37) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL909304 0.91 APLNR (0.39) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL909303 0.91 APLNR (0.39) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL909010 0.82 CTSS (0.32) APLNRLMNAPOLB
SCHEMBL909754 0.71 APLNR (0.40) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL909112 0.70 APLNR (0.39) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL908694 0.70 APLNR (0.39) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL1533163 0.70 APLNR (0.41) APLNRGAAALDH1A1ANPEPLMNA
SCHEMBL1532859 0.69 APLNR (0.38) APLNRGAAALDH1A1ANPEPLMNA

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-9453000-B2 Polycyclic compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2016-09-27 US disclosed
EP-2181992-B1 POLYCYCLIC COMPOUND EISAI R&D MAN CO LTD (JP) 2013-05-01 EP disclosed
EP-2559693-A1 Polycyclic compound Eisai R&D Management Co., Ltd. (JP) 2013-02-20 EP disclosed
US-7935815-B2 Imidazoyl pyridine compounds and salts thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-05-03 US disclosed
US-20110065696-A1 IMIDAZOYL PYRIDINE COMPOUNDS AND SALTS THEREOF KIMURA TEIJI 2011-03-17 US disclosed
US-20110009619-A1 POLYCYCLIC COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-01-13 US disclosed
EP-2181992-A1 POLYCYCLIC COMPOUND Eisai R&D Management Co., Ltd. (JP) 2010-05-05 EP disclosed
US-20090062529-A1 MULTI-CYCLIC COMPOUNDS EISAI R&D MANAGEMENT CO., LTD., (JP) 2009-03-05 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-20110009619-A1 POLYCYCLIC COMPOUND APP, BACE1, PSEN1 APLNR 1641/4885GAA 2325/4885ALDH1A1 1741/4885
US-20110065696-A1 IMIDAZOYL PYRIDINE COMPOUNDS AND SALTS THEREOF APP, PSEN1, BACE1 APLNR 3431/4885GAA 1935/4885ALDH1A1 943/4885
US-20090062529-A1 MULTI-CYCLIC COMPOUNDS APP, BACE1, PSEN1 APLNR 2385/4885GAA 1552/4885ALDH1A1 1583/4885

“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.