SCHEMBL19782065

SCHEMBL19782065

N#Cc1cncc(S)c1N

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CSNK1A1 P48729 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
TRPV4 Q9HBA0 1/20 0.33
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL21922075 0.84 CSNK1A1 (0.40) CSNK1A1CLK4CYP11B1CYP11B2ADORA2A
SCHEMBL29768800 0.77 CSNK1A1 (0.36) CSNK1A1CLK4CYP11B1CYP11B2ADORA2A
SCHEMBL19779692 0.74 TSHR (0.37) CSNK1A1CLK4CYP11B1CYP11B2
SCHEMBL18125583 0.74 CYP11B2 (0.45) CYP11B1CYP11B2
SCHEMBL1999359 0.71 HTT (0.34) CSNK1A1CLK4CYP11B1CYP11B2
SCHEMBL19779742 0.69 CYP2E1 (0.37) CSNK1A1CLK4CYP11B1CYP11B2
SCHEMBL27294895 0.69 KDM4E (0.46) CLK4CYP11B1CYP11B2
SCHEMBL22096833 0.69 CYP11B1 (0.32) CSNK1A1CLK4CYP11B1CYP11B2
SCHEMBL19768943 0.69 KDM5A (0.36) CSNK1A1CLK4CYP11B1CYP11B2
SCHEMBL21883804 0.67

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-2018013676-A1 SOMATOSTATIN MODULATORS AND USES THEREOF Crinetics Pharmaceuticals, Inc. (US) 2018-01-18 WO disclosed