SCHEMBL31500952

SCHEMBL31500952

COC(=O)CNC1CCC(Nc2ncc(F)c(-c3cnc4ccccn34)n2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 8/20 0.53
▸ MAPK8 P45983 5/20 0.53
▸ MAPK9 P45984 4/20 0.53
▸ JUN P05412 2/20 0.53
▸ IGF1R P08069 13/20 0.53
▸ MAPK10 P53779 2/20 0.47
▸ IRAK4 Q9NWZ3 2/20 0.47
▸ KCNH2 Q12809 4/20 0.43
▸ CCNT1 O60563 1/20 0.42
▸ FLT3 P36888 1/20 0.42
▸ CDK9 P50750 1/20 0.42
▸ INSR P06213 1/20 0.42

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
SCHEMBL22228848 0.90 CDK2 (0.53) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL22252970 0.90 IGF1R (0.48) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL20460640 0.87 MAPK10 (0.58) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL22228927 0.83 CDK2 (0.51) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL22228925 0.83 CDK2 (0.51) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL31501022 0.81 CDK9 (0.58) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL31501018 0.81 CDK9 (0.58) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL22228715 0.81 CDK9 (0.58) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL31501021 0.81 CDK9 (0.58) CDK2MAPK8MAPK9JUNIGF1R
SCHEMBL22228694 0.81 CDK2 (0.62) CDK2MAPK8MAPK9JUNIGF1R

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-3577116-B1 DERIVATIVES OF N-CYCLOALKYL/HETEROCYCLOALKYL-4-(IMIDAZO[1,2-A]PYRIDINE)PYRIMIDIN-2-AMINE AS THERAPEUTIC AGENTS CHANGZHOU QIANHONG BIO PHARMA CO LTD (CN) 2025-04-23 — — EP disclosed
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