SCHEMBL25920482

SCHEMBL25920482

CNc1cnn2c1CNCCC2

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.36
SSTR4 P31391 1/20 0.31
CYP11B1 P15538 2/20 0.31
CYP11B2 P19099 2/20 0.31
CXCR4 P61073 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
SCHEMBL26686835 0.90 WNT1 (0.33) LRRK2
SCHEMBL20939740 0.78 CYP11B1 (0.38) SSTR4CYP11B1CYP11B2CXCR4
SCHEMBL18879068 0.78 LRRK2 (0.52) LRRK2SSTR4CYP11B1CYP11B2
SCHEMBL30793786 0.75 CREBBP (0.39) SSTR4CXCR4
SCHEMBL31207890 0.75 CXCR4 (0.38) CYP11B1CYP11B2CXCR4
SCHEMBL19629799 0.71 WNT1 (0.39) SSTR4
SCHEMBL30793511 0.69 SPR (0.34) SSTR4CXCR4
SCHEMBL31739404 0.69 RPS6KB1 (0.40) SSTR4CXCR4
SCHEMBL25910758 0.69 LRRK2 (0.35) LRRK2
SCHEMBL25587246 0.68 LRRK2 (0.54) 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-2023141300-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF KUMQUAT BIOSCIENCES INC. (US) 2023-07-27 WO disclosed