SCHEMBL31403622

SCHEMBL31403622

CC(C)n1ncc2c(Cl)nc(N)nc21

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 2/20 0.46
ADORA1 P30542 2/20 0.46
KDM4E B2RXH2 2/20 0.44
KMT2A Q03164 1/20 0.44
PDE1C Q14123 2/20 0.43
PDE9A O76083 9/20 0.42
HSP90AA1 P07900 4/20 0.41
TRAP1 Q12931 4/20 0.41
HSP90AB1 P08238 1/20 0.40
HSP90B1 P14625 1/20 0.40
ADA P00813 1/20 0.38

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
SCHEMBL8418316 0.89 ADORA2A (0.42) ADORA2AADORA1KDM4EKMT2APDE1C
SCHEMBL21459294 0.83 CDK1 (0.44) KDM4EKMT2APDE1CPDE9A
SCHEMBL2357706 0.83 KDM4E (0.43) KDM4EKMT2APDE1CPDE9A
SCHEMBL29399563 0.83 CDK1 (0.44) KDM4EKMT2APDE1CPDE9A
SCHEMBL23918240 0.81 KDM4E (0.42) KDM4EKMT2APDE1CPDE9A
SCHEMBL31051051 0.81 KDM4E (0.42) KDM4EKMT2APDE1CPDE9A
SCHEMBL31403538 0.80 KDM4E (0.41) KDM4EKMT2APDE1CPDE9A
SCHEMBL31403549 0.80 KDM4E (0.41) KDM4EKMT2APDE1CPDE9A
SCHEMBL21282841 0.78 KDM4E (0.40) KDM4EKMT2APDE1CPDE9A
SCHEMBL29174768 0.78 KDM4E (0.40) KDM4EKMT2APDE1CPDE9A

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-2025076284-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed