SCHEMBL29944807

SCHEMBL29944807

CCn1cc(Nc2nc(NC3CNCCC34CC4)c3c(Cl)c[nH]c3n2)cn1

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 19/20 0.56
BTK Q06187 19/20 0.56
EGFR P00533 1/20 0.46

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
SCHEMBL23690726 0.92 JAK3 (0.56) JAK3BTKEGFR
SCHEMBL23690859 0.84 JAK3 (0.65) JAK3BTKEGFR
SCHEMBL23690782 0.82 JAK3 (0.76) JAK3BTKEGFR
SCHEMBL23690779 0.82 JAK3 (0.76) JAK3BTKEGFR
SCHEMBL23690781 0.82 JAK3 (0.76) JAK3BTKEGFR
SCHEMBL23691109 0.81 EGFR (0.55) JAK3BTKEGFR
SCHEMBL23690727 0.81 JAK3 (0.72) JAK3BTKEGFR
SCHEMBL23690725 0.81 JAK3 (0.72) JAK3BTKEGFR
SCHEMBL23690973 0.80 JAK3 (0.66) JAK3BTKEGFR
SCHEMBL23690757 0.80 JAK3 (0.62) JAK3BTKEGFR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115244055-B Pyrimidine five-membered ring derivative and application thereof 江苏先声药业有限公司 2024-09-03 CN disclosed
CN-115244055-A Pyrimido five-membered ring derivative and application thereof 江苏先声药业有限公司 2022-10-25 CN disclosed