SCHEMBL23299634

SCHEMBL23299634

Cn1cc(Nc2nccc(N3CCC(C)(C(=O)NCC(F)(F)F)CC3)n2)cn1

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 20/20 0.66
▸ JAK1 P23458 20/20 0.66
▸ TYK2 P29597 20/20 0.66
▸ JAK3 P52333 7/20 0.66
▸ KDR P35968 1/20 0.53
▸ STAT1 P42224 1/20 0.53

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
SCHEMBL23299630 0.86 JAK2 (0.66) JAK2JAK1TYK2JAK3KDR
SCHEMBL23276971 0.84 JAK2 (0.60) JAK2JAK1TYK2JAK3KDR
SCHEMBL23276796 0.83 JAK1 (0.56) JAK2JAK1TYK2JAK3KDR
SCHEMBL23299632 0.83 JAK2 (0.60) JAK2JAK1TYK2JAK3KDR
SCHEMBL23276827 0.82 JAK2 (0.57) JAK2JAK1TYK2JAK3KDR
SCHEMBL23299601 0.81 JAK2 (0.61) JAK2JAK1TYK2JAK3KDR
SCHEMBL23276839 0.80 JAK2 (0.56) JAK2JAK1TYK2JAK3KDR
SCHEMBL23299635 0.79 JAK2 (0.65) JAK2JAK1TYK2JAK3KDR
SCHEMBL23276897 0.78 JAK2 (0.58) JAK2JAK1TYK2JAK3KDR
SCHEMBL23276875 0.77 JAK2 (0.59) JAK2JAK1TYK2JAK3KDR

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
Send feedback