SCHEMBL15134405

SCHEMBL15134405

O=C1CCCCCCCC(C(=O)O)N1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MME P08473 14/20 0.46
ACE P12821 9/20 0.46
CAD P27708 1/20 0.44
ECE1 P42892 1/20 0.44
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL4903224 1.00 MME (0.46) MMEACECADECE1KDM4E
SCHEMBL18576543 1.00 MME (0.46) MMEACECADECE1KDM4E
SCHEMBL20367630 1.00 MME (0.46) MMEACECADECE1KDM4E
SCHEMBL6814128 0.98 MME (0.44) MMEACECADECE1KDM4E
SCHEMBL6813416 0.98 MME (0.44) MMEACECADECE1KDM4E
SCHEMBL6501628 0.98 MME (0.44) MMEACECADECE1KDM4E
SCHEMBL2344195 0.92 CAD (0.43) MMEACECAD
SCHEMBL630497 0.92 CAD (0.43) MMEACECAD
SCHEMBL3625069 0.92 CAD (0.43) MMEACECAD
SCHEMBL3258686 0.90 FKBP5 (0.52) MMEACEECE1KDM4EPOLB

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-10640534-B2 Therapeutically active compositions and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2020-05-05 US disclosed
US-20180194802-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2018-07-12 US disclosed
US-9850277-B2 Therapeutically active compositions and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2017-12-26 US disclosed
US-20170057994-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-03-02 US disclosed
US-20170015703-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE SERVIER PHARMACEUTICALS LLC 2017-01-19 US disclosed
US-9474779-B2 Therapeutically active compositions and their methods of use AGIOS PHARMACEUTICALS, INC. (US) 2016-10-25 US disclosed
WO-2015010297-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC. (US) 2015-01-29 WO disclosed
US-20130190249-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE AGIOS PHARMACEUTICALS, INC (US) 2013-07-25 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 (5 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-20170015703-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A MME 2149/4885ACE 2416/4885CAD 4174/4885
US-20130190249-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A MME 2149/4885ACE 2416/4885CAD 4174/4885
US-20180194802-A1 THERAPEUTICALLY ACTIVE COMPOSITIONS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A MME 2149/4885ACE 2416/4885CAD 4174/4885
US-10640534-B2 Therapeutically active compositions and their methods of use IDH1, IDH3B, IDH3A MME 2149/4885ACE 2416/4885CAD 4174/4885
US-20170057994-A1 THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE IDH1, IDH3B, IDH3A MME 2374/4885ACE 2827/4885CAD 4620/4885

“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.