SCHEMBL38658652

SCHEMBL38658652

Nc1nc2c(F)cccc2c2nccn12

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 13/20 0.48
CCNE2 O96020 2/20 0.40
CCNE1 P24864 2/20 0.40
CDK2 P24941 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.35
ADORA1 P30542 5/20 0.33
PDE10A Q9Y233 1/20 0.33
PARP1 P09874 1/20 0.33
PTPN11 Q06124 1/20 0.33
ADORA3 P0DMS8 1/20 0.33

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
SCHEMBL87054 0.76 ADORA2A (0.49) ADORA2ASMN1; SMN2ADORA3
Bromide SCHEMBL80836 0.74 ADORA2A (0.48) ADORA2ASMN1; SMN2ADORA3
SCHEMBL21063123 0.72 ADORA2A (0.47) ADORA2AADORA1PDE10A
SCHEMBL29995283 0.72 ADORA2A (0.47) ADORA2AADORA1PDE10A
SCHEMBL21063018 0.71 KDM4E (0.45) ADORA2ASMN1; SMN2ADORA1ADORA3
SCHEMBL38657824 0.71 GRM2 (0.48) ADORA2ACDK2ADORA1
SCHEMBL21063161 0.69 ADORA2A (0.44) ADORA2ASMN1; SMN2ADORA1PDE10AADORA3
SCHEMBL29996830 0.69 ADORA2A (0.44) ADORA2ASMN1; SMN2ADORA1PDE10AADORA3
SCHEMBL23948351 0.68 PDE2A (0.47) SMN1; SMN2PDE10APARP1
SCHEMBL1010207 0.66 DHFR (0.45) ADORA2ASMN1; SMN2ADORA1

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
EP-3723754-B1 IMIDAZO [1,2-C] QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES MERCK SHARP & DOHME LLC (US) 2026-05-13 EP claimed