SCHEMBL1648248

SCHEMBL1648248

COC(=O)c1cc(C=CCN2CCOCC2)ccc1OCc1ccc(F)cc1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.52
APP P05067 4/20 0.47
MAPT P10636 5/20 0.47
KMT2A Q03164 2/20 0.47
KDM4E B2RXH2 7/20 0.46
MEN1 O00255 1/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 3/20 0.42
MAPK1 P28482 2/20 0.42
FFAR4 Q5NUL3 1/20 0.42
ALDH1A1 P00352 3/20 0.42
TSHR P16473 1/20 0.42
L3MBTL1 Q9Y468 2/20 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
SCHEMBL1648246 1.00 SMN1; SMN2 (0.52) SMN1; SMN2APPMAPTKMT2AKDM4E
SCHEMBL10322916 0.82 LRRK2 (0.61)
SCHEMBL10322917 0.82 LRRK2 (0.61)
SCHEMBL1648477 0.81 SMN1; SMN2 (0.49) SMN1; SMN2KMT2AKDM4EHPGDLMNA
SCHEMBL1646758 0.79 HSD17B10 (0.57) SMN1; SMN2MAPTKMT2AHPGDLMNA
SCHEMBL1647115 0.78 FFAR4 (0.50) SMN1; SMN2APPMAPTKMT2AKDM4E
SCHEMBL1647118 0.78 FFAR4 (0.50) SMN1; SMN2APPMAPTKMT2AKDM4E
SCHEMBL10322212 0.75 LRRK2 (0.53) SMN1; SMN2FFAR4
SCHEMBL2249223 0.73 ALDH1A1 (0.53) SMN1; SMN2MAPTKMT2AKDM4EMEN1
SCHEMBL2249228 0.73 ALDH1A1 (0.53) SMN1; SMN2MAPTKMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2483254-B1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2014-08-13 EP disclosed
US-8778939-B2 Compounds GLAXO GROUP LIMITED (GB) 2014-07-15 US disclosed
EP-2483254-A1 NOVEL COMPOUNDS Glaxo Group Limited (GB) 2012-08-08 EP disclosed
US-20120184553-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-07-19 US disclosed
WO-2011038572-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2011-04-07 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-20120184553-A1 NOVEL COMPOUNDS LRRK2, PARK7, PINK1 SMN1; SMN2 769/4885APP 33/4885MAPT 9/4885

“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.