SCHEMBL25239999

SCHEMBL25239999

C=C(C)C1COC2(CCN(C(=O)O)C2)C1

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.31

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
SCHEMBL25280550 0.88 CHRM4 (0.30)
SCHEMBL16416530 0.78 CNR2 (0.41) MGLL
SCHEMBL28699521 0.71 ALDH1A1 (0.33)
SCHEMBL25285018 0.71
SCHEMBL25309379 0.70
SCHEMBL3353155 0.70 MGLL (0.30) MGLL
SCHEMBL3353153 0.70 MGLL (0.30) MGLL
SCHEMBL3353158 0.70 MGLL (0.30) MGLL
SCHEMBL25283419 0.69
SCHEMBL3352527 0.68 CNR2 (0.35) MGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023110394-A1 PROCESS FOR C-H INSERTION BY GEM-HYDROGENATION OF AN INTERNAL ALKYNE STUDIENGESELLSCHAFT KOHLE GGMBH (DE) 2023-06-22 WO disclosed
EP-4198038-A1 PROCESS FOR C-H INSERTION BY GEM-HYDROGENATION OF AN INTERNAL ALKYNE Studiengesellschaft Kohle mbH (DE) 2023-06-21 EP disclosed