SCHEMBL23276845

SCHEMBL23276845

CC[C@H]1CN(c2ccnc(Nc3cnn(C)c3)n2)CCN1C(=O)C1CC1(F)F

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ JAK1 P23458 20/20 0.69
▸ JAK2 O60674 16/20 0.69
▸ TYK2 P29597 16/20 0.69
▸ JAK3 P52333 4/20 0.69
▸ KDR P35968 2/20 0.69
▸ STAT1 P42224 1/20 0.69
▸ PRMT7 Q9NVM4 1/20 0.60

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
SCHEMBL23276597 1.00 JAK1 (0.69) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276595 1.00 JAK1 (0.69) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276685 0.89 JAK1 (0.69) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276594 0.89 JAK1 (0.69) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276596 0.89 JAK1 (0.69) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276923 0.85 JAK2 (0.59) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276745 0.85 JAK2 (0.59) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276743 0.85 JAK2 (0.59) JAK1JAK2TYK2JAK3KDR
SCHEMBL23299627 0.83 JAK2 (0.57) JAK1JAK2TYK2JAK3KDR
SCHEMBL23276598 0.83 JAK2 (0.57) JAK1JAK2TYK2JAK3KDR

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-2021078021-A1 SMALL MOLECULAR COMPOUND 嘉兴特科罗生物科技有限公司 2021-04-29 — — WO disclosed
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