SCHEMBL24896463

SCHEMBL24896463

Cn1c(C=O)cc2ccnc(OC3CC3)c21

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 10/20 0.38
KCNH2 Q12809 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
HCRTR1 O43613 3/20 0.32
HCRTR2 O43614 3/20 0.32
GRM4 Q14833 1/20 0.31
DRD1 P21728 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
SCHEMBL24896464 0.78 KDM4E (0.39) HCRTR1HCRTR2GRM4
SCHEMBL24896309 0.77 CCNA2 (0.33)
SCHEMBL30220512 0.74 MAOA (0.38) HCRTR1HCRTR2
SCHEMBL24896380 0.74 DYRK1A (0.36)
SCHEMBL29942068 0.74 RXFP1 (0.37)
SCHEMBL23755342 0.74 RXFP1 (0.37)
SCHEMBL24896382 0.69 GRM4 (0.35) GRM4
SCHEMBL25003510 0.68 ACACB (0.35) GRM4
SCHEMBL24896465 0.65 KMO (0.35) LRRK2GRM4
SCHEMBL29721829 0.63 TRIM24 (0.46) LRRK2

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
WO-2023287704-A1 BICYCLIC COMPOUNDS AS ANDROGEN RECEPTOR MODULATORS NIDO BIOSCIENCES, INC. (US) 2023-01-19 WO disclosed