SCHEMBL23111145

SCHEMBL23111145

CN1CCOc2cc(CO)cnc21

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 11/20 0.62
CYP11B2 P19099 3/20 0.50
IRAK4 Q9NWZ3 1/20 0.36
PDE10A Q9Y233 1/20 0.35
MGLL Q99685 2/20 0.35
SYK P43405 1/20 0.35
CYP11B1 P15538 1/20 0.35

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
SCHEMBL12526123 0.86 GRM5 (0.64) GRM5CYP11B2IRAK4PDE10ASYK
SCHEMBL18291839 0.85 GRM5 (0.62) GRM5CYP11B2IRAK4PDE10AMGLL
SCHEMBL2459912 0.82 GRM5 (0.60) GRM5CYP11B2IRAK4PDE10A
SCHEMBL15520747 0.80 GRM5 (0.56) GRM5CYP11B2IRAK4MGLLCYP11B1
SCHEMBL15889737 0.78 GRM5 (0.65) GRM5CYP11B2IRAK4PDE10AMGLL
SCHEMBL46326 0.78 GRM5 (0.57) GRM5CYP11B2IRAK4MGLLSYK
SCHEMBL1053384 0.76 GRM5 (0.56) GRM5CYP11B2IRAK4MGLLSYK
SCHEMBL2398608 0.76 GRM5 (0.56) GRM5CYP11B2IRAK4MGLLSYK
SCHEMBL18307164 0.76 GRM5 (0.56) GRM5CYP11B2IRAK4MGLLSYK
SCHEMBL3663437 0.76 GRM5 (0.52) GRM5CYP11B2IRAK4MGLLCYP11B1

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
EP-3475262-B1 BICYCLIC IMIDAZOLE DERIVATIVES USEFUL FOR THE TREATMENT OF RENAL DISEASE, CARDIOVASCULAR DISEASES AND FIBROTIC DISORDERS BOEHRINGER INGELHEIM INT (DE) 2021-03-24 EP disclosed