SCHEMBL23921963

SCHEMBL23921963

C=C(C(N)=O)c1cccc(-c2cc(CN3CCOCC3)cc(Nc3ncc(C)s3)n2)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 4/20 0.46
KDR P35968 4/20 0.43
LCK P06239 1/20 0.40
KIT P10721 2/20 0.40
FLT3 P36888 2/20 0.40
MAP3K12 Q12852 1/20 0.40
ALK Q9UM73 1/20 0.39
SYK P43405 1/20 0.39
HCK P08631 1/20 0.38
BTK Q06187 1/20 0.38
JAK2 O60674 2/20 0.38
KCNH2 Q12809 2/20 0.38
JAK3 P52333 1/20 0.38
SRC P12931 1/20 0.38
DYRK1A Q13627 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
SCHEMBL29743061 1.00 CHEK1 (0.46) CHEK1KDRLCKKITFLT3
SCHEMBL29743069 0.88 CHEK1 (0.43) CHEK1KDRLCKSYKHCK
SCHEMBL23921962 0.88 KDR (0.46) KDRMAP3K12
SCHEMBL23921961 0.88 KDR (0.48) CHEK1KDRLCKKITFLT3
SCHEMBL29743067 0.87 LCK (0.42) CHEK1KDRLCKHCKBTK
SCHEMBL28893696 0.86 CHEK1 (0.42) CHEK1KDRLCKKITFLT3
SCHEMBL29838449 0.86 KDR (0.44) CHEK1KDRLCKKITFLT3
SCHEMBL22206182 0.85 JAK3 (0.45) CHEK1KDRLCKALKHCK
SCHEMBL20908740 0.83 EGFR (0.52) HCKBTKJAK2JAK3
SCHEMBL22215290 0.83 KDR (0.44) CHEK1KDRKITFLT3SYK

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
US-11149019-B2 Phenylpyridine derivative and pharmaceutical composition comprising the same DAEWOONG PHARMACEUTICAL CO., LTD. (KR) 2021-10-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11149019-B2 Phenylpyridine derivative and pharmaceutical composition comprising the same DPYD, PDCD5, PDCD1 CHEK1 1981/4885KDR 3048/4885LCK 283/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.