SCHEMBL30822669

SCHEMBL30822669

O=c1c2c(Cl)ccc(F)c2ccn1-c1cc[nH]n1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
JAK3 P52333 1/20 0.34
EGFR P00533 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
SCHEMBL30822715 0.90 EGFR (0.33) JAK2JAK1TYK2JAK3EGFR
SCHEMBL30822709 0.79 ALK (0.36) JAK2JAK1TYK2JAK3EGFR
SCHEMBL30822695 0.78 GRM1 (0.32)
SCHEMBL30822687 0.76 JAK2 (0.39) JAK2JAK1TYK2JAK3EGFR
SCHEMBL30822664 0.74 CYP1A2 (0.37) JAK2JAK1TYK2JAK3
SCHEMBL30822732 0.73 PARP1 (0.33) EGFR
SCHEMBL30822648 0.72 PIK3CD (0.35)
SCHEMBL29164788 0.72 PIK3CD (0.35)
SCHEMBL30822685 0.70 CHEK1 (0.39)
SCHEMBL17336303 0.67 PARP1 (0.42) JAK2JAK1TYK2JAK3

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
CN-117659001-A Aminopyrimidine derivatives and their use in medicine 广东东阳光药业股份有限公司 2024-03-08 CN disclosed