SCHEMBL11941255

SCHEMBL11941255

C[C@@H]1N(C)C=CN1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.36
GSK3A P49840 1/20 0.34
GSK3B P49841 1/20 0.34
MAPK1 P28482 1/20 0.34
GAA P10253 1/20 0.32
G6PD P11413 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LOX P28300 1/20 0.32
LOXL3 P58215 1/20 0.32
LOXL4 Q96JB6 1/20 0.32
LOXL2 Q9Y4K0 1/20 0.32
ELANE P08246 1/20 0.31
ALDH1A1 P00352 2/20 0.30
GFER P55789 1/20 0.30
USP2 O75604 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
ALOX5 P09917 1/20 0.30

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
SCHEMBL18250336 1.00 MAOA (0.36) MAOAGSK3AGSK3BMAPK1GAA
SCHEMBL1834758 1.00 MAOA (0.36) MAOAGSK3AGSK3BMAPK1GAA
SCHEMBL12170156 0.86 MAOA (0.41) MAOAGSK3AGSK3BMAPK1GAA
SCHEMBL21102556 0.85 KDM4E (0.32) GAAALDH1A1HPGD
SCHEMBL16709178 0.84 MAPK1 (0.32) MAOAMAPK1
SCHEMBL16711466 0.75 MAOA (0.34) MAOAMAPK1GAAG6PDL3MBTL1
SCHEMBL22370019 0.75 MAOA (0.34) MAOAGAAG6PDL3MBTL1LOX
SCHEMBL5290702 0.75 MAPT (0.38) GSK3AGSK3BMAPK1GAAALDH1A1
SCHEMBL5285912 0.75 DRD2 (0.40) MAOAMAPK1GAAL3MBTL1ELANE
SCHEMBL20368519 0.75 MAOA (0.32) MAOAMAPK1ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120187381-A1 Electron Transporting Compounds UNIVERSAL DISPLAY CORPORATION (US) 2012-07-26 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-20120187381-A1 Electron Transporting Compounds SLC19A2, ABCB7, SLCO2B1 MAOA 614/4885GSK3A 4843/4885GSK3B 4826/4885

“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.