SCHEMBL23648347

SCHEMBL23648347

CCN1CCC(c2ccc(N)cn2)CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.43
GAA P10253 2/20 0.42
MAPT P10636 2/20 0.42
RAD52 P43351 2/20 0.42
GFER P55789 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 1/20 0.42
KDM5A P29375 1/20 0.41
DRD4 P21917 3/20 0.39
DRD2 P14416 2/20 0.39
MAP4K4 O95819 1/20 0.36
GCK P35557 1/20 0.36
MAP4K3 Q8IVH8 1/20 0.36
MAP4K1 Q92918 1/20 0.36
MAP4K5 Q9Y4K4 1/20 0.36
HRH3 Q9Y5N1 3/20 0.36
DRD3 P35462 1/20 0.36
TRPC6 Q9Y210 3/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL171290 0.84 DRD4 (0.52) SYKKDM5ADRD4DRD2MAP4K4
SCHEMBL13724434 0.82 KDM5A (0.44) SYKGAAMAPTGFERSMN1; SMN2
SCHEMBL13724359 0.81 MAP3K12 (0.45) KDM5ADRD4DRD2MAP4K4DRD3
SCHEMBL171089 0.81 ALDH1A1 (0.43) SYKSMN1; SMN2KDM4EDRD4DRD2
SCHEMBL13490551 0.80 DRD2 (0.52) DRD4DRD2HRH3DRD3
SCHEMBL3388699 0.79 NOTUM (0.43) KDM5A
SCHEMBL30141664 0.79 NOTUM (0.43) KDM5A
SCHEMBL15636018 0.76 CHRNA7 (0.41) MAPTGFERSMN1; SMN2KDM4EKDM5A
SCHEMBL29739657 0.76 KDM5A (0.40) SMN1; SMN2KDM5AMAP4K4ALDH1A1
SCHEMBL1546893 0.76 USP30 (0.48) DRD4DRD2HRH3DRD3ALDH1A1

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-2021145520-A1 7-AMINO-3,4-DIHYDROPYRIMIDOPYRIMIDIN-2-ONE DERIVATIVE HAVING INHIBITORY ACTIVITY FOR PROTEIN KINASES AND THERAPEUTIC PHARMACEUTICAL COMPOSITION COMPRISING SAME 한국과학기술연구원 2021-07-22 WO disclosed