SCHEMBL31474084

SCHEMBL31474084

CC1Oc2cnccc2-c2ccc(Br)cc21

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AAK1 Q2M2I8 6/20 0.53
ROCK2 O75116 13/20 0.48
CCNC P24863 1/20 0.47
CDK8 P49336 1/20 0.47
HASPIN Q8TF76 1/20 0.47
CDK19 Q9BWU1 1/20 0.47
ROCK1 Q13464 2/20 0.47

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
SCHEMBL15241059 0.88 AAK1 (0.50) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL19946024 0.82 AAK1 (0.53) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL16377274 0.78 ROCK2 (0.70) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL18901118 0.75 AAK1 (0.51) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL15240307 0.73 AAK1 (0.50) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL15973795 0.73 AAK1 (0.53) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL10112293 0.72 TNF (0.37) AAK1ROCK2ROCK1
Hydrochloric Acid SCHEMBL15973647 0.72 AAK1 (0.52) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL21018898 0.72 AAK1 (0.70) AAK1ROCK2CCNCCDK8HASPIN
SCHEMBL20164880 0.70 AAK1 (1.00) AAK1ROCK2ROCK1

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-2025060978-A1 TRICYCLIC PYRIDINE COMPOUND ACTING AS SARM1 ENZYME ACTIVITY INHIBITOR, AND USE THEREOF 科辉智药(深圳)新药研究中心有限公司 2025-03-27 WO disclosed