SCHEMBL17800690

SCHEMBL17800690

CC1(C)OB(C2=CCN(B3OC(C)(C)C(C)(C)O3)C=C2)OC1(C)C

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.37
MAPK1 P28482 1/20 0.35
LPL P06858 1/20 0.30
LIPG Q9Y5X9 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
SCHEMBL17800687 0.80 P2RX7 (0.31) P2RX7
SCHEMBL17800667 0.79 P2RX7 (0.30) P2RX7
SCHEMBL17800708 0.76
SCHEMBL29656556 0.75 P2RX7 (0.34) P2RX7MAPK1
SCHEMBL17800700 0.72 LPL (0.39) LPLLIPG
SCHEMBL17800698 0.72
SCHEMBL17800682 0.68
SCHEMBL10088213 0.67 P2RX7 (0.42) P2RX7MAPK1LPLLIPG
SCHEMBL2752497 0.64 P2RX7 (0.44) P2RX7MAPK1LPLLIPG
SCHEMBL29574026 0.64 MAPK1 (0.42) P2RX7MAPK1LPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9862732-B2 Regioselective 1,2-dearomatization of functionalized azines by organolanthanide catalysts NORTHWESTERN UNIVERSITY (US) 2018-01-09 US claimed
US-20160159825-A1 Regioselective 1,2-Dearomatization of Functionalized Azines by Organolanthanide Catalysts NATIONAL SCIENCE FOUNDATION 2016-06-09 US claimed
US-9862732-B2 Regioselective 1,2-dearomatization of functionalized azines by organolanthanide catalysts NORTHWESTERN UNIVERSITY (US) 2018-01-09 US disclosed
US-20160159825-A1 Regioselective 1,2-Dearomatization of Functionalized Azines by Organolanthanide Catalysts NATIONAL SCIENCE FOUNDATION 2016-06-09 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-20160159825-A1 Regioselective 1,2-Dearomatization of Functionalized Azines by Organolanthanide Catalysts DERL1, AZI2, AOC2 P2RX7 1471/4885MAPK1 1827/4885LPL 1382/4885

“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.