SCHEMBL6345109

SCHEMBL6345109

CCOC(=O)Cc1ncccc1C1CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.48
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 1/20 0.42
KDM4E B2RXH2 3/20 0.40
HSD17B10 Q99714 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
BRD4 O60885 1/20 0.40
SSTR4 P31391 1/20 0.40
NOS2 P35228 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CYP2C19 P33261 1/20 0.39
ELANE P08246 1/20 0.39
CASP1 P29466 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL10517209 0.85 SSTR4 (0.42) MAPTMAPK1SMN1; SMN2SSTR4NOS2
SCHEMBL21767564 0.80 PKM (0.48) ALDH1A1KDM4EHSD17B10L3MBTL1PKM
SCHEMBL6344652 0.79 MAPT (0.54) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL7010780 0.78 MAPT (0.53) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL31347161 0.77 MAPT (0.52) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL4882694 0.77 MAPT (0.52) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL10131983 0.77 MAPT (0.52) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL932150 0.77 MAPT (0.58) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL10132049 0.77 MAPT (0.52) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA
SCHEMBL5791166 0.77 MAPT (0.52) MAPTMAPK1ALDH1A1SMN1; SMN2LMNA

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-2334684-B1 PYRAZOLOPYRIMIDINES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS BOEHRINGER INGELHEIM INT (DE) 2017-08-02 EP disclosed
US-9079905-B2 Compounds for the treatment of CNS disorders BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-07-14 US disclosed
US-9079905-B2 Compounds for the treatment of CNS disorders BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-07-14 US disclosed
US-20120115863-A1 COMPOUNDS FOR THE TREATMENT OF CNS DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-10 US disclosed
US-20120115863-A1 COMPOUNDS FOR THE TREATMENT OF CNS DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-10 US disclosed
WO-2010026214-A1 PYRAZOLOPYRIMIDINES AND THEIR USE FOR THE TREATMENT OF CNS DISORDERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-03-11 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-20120115863-A1 COMPOUNDS FOR THE TREATMENT OF CNS DISORDERS CNR1, CNR2, CHRM5 MAPT 307/4885MAPK1 1647/4885ALDH1A1 956/4885

“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.