SCHEMBL17846809

SCHEMBL17846809

CC1=CN(C)C(C)=CN1C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.32
GSK3B P49841 1/20 0.32
MGLL Q99685 1/20 0.32

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
SCHEMBL7106578 0.91
SCHEMBL22931329 0.70
SCHEMBL19558036 0.66
SCHEMBL369355 0.48
SCHEMBL895221 0.44
SCHEMBL11277497 0.44
SCHEMBL10017669 0.44
SCHEMBL1468768 0.43
P-Xylene SCHEMBL11770184 0.41 ACHE (1.00)
P-Xylene SCHEMBL460348 0.41 ACHE (1.00)

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
US-11773052-B2 Enamine compound and use thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2023-10-03 US disclosed
US-11773052-B2 Enamine compound and use thereof JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2023-10-03 US disclosed
US-20200087245-A1 ENAMINE COMPOUND AND USE THEREOF JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2020-03-19 US disclosed
US-20170348681-A1 ACTIVATION OF SUPPORTED OLEFIN METATHESIS CATALYSTS BY ORGANIC REDUCTANTS ETH ZURICH (CH) 2017-12-07 US disclosed
EP-3233274-A1 ACTIVATION OF SUPPORTED OLEFIN METATHESIS CATALYSTS BY ORGANIC REDUCTANTS ETH Zürich (CH) 2017-10-25 EP disclosed
WO-2016095061-A1 ACTIVATION OF SUPPORTED OLEFIN METATHESIS CATALYSTS BY ORGANIC REDUCTANTS ETH ZURICH (CH) 2016-06-23 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 (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-20200087245-A1 ENAMINE COMPOUND AND USE THEREOF ENY2, AHR, PAH GSK3A 4651/4885GSK3B 4593/4885MGLL 4128/4885
US-11773052-B2 Enamine compound and use thereof ENY2, AHR, PAH GSK3A 4651/4885GSK3B 4593/4885MGLL 4128/4885
US-20170348681-A1 ACTIVATION OF SUPPORTED OLEFIN METATHESIS CATALYSTS BY ORGANIC REDUCTANTS MON2, MSMO1, SGMS2 GSK3A 2323/4885GSK3B 2448/4885MGLL 434/4885

“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.