SCHEMBL22736491

SCHEMBL22736491

CS(=O)(=O)CC(Cc1ccc(-n2cc(-c3ccnc4[nH]cnc34)cn2)nc1)C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 6/20 0.33
▸ JAK1 P23458 4/20 0.32
▸ KDM4A O75164 1/20 0.32
▸ KDM4B O94953 1/20 0.32
▸ KDM5C P41229 1/20 0.32
▸ KDM5B Q9UGL1 1/20 0.32
▸ JAK3 P52333 2/20 0.31
▸ GRM4 Q14833 1/20 0.31
▸ TYK2 P29597 1/20 0.30

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
SCHEMBL29567204 1.00 JAK2 (0.33) JAK2JAK1KDM4AKDM4BKDM5C
SCHEMBL22736489 0.87 GRM4 (0.33) JAK2JAK1KDM4AKDM4BKDM5C
SCHEMBL29567716 0.87 GRM4 (0.33) JAK2JAK1KDM4AKDM4BKDM5C
SCHEMBL29567114 0.85 JAK2 (0.33) JAK2JAK1JAK3GRM4TYK2
SCHEMBL22736278 0.84 GRM4 (0.35) JAK2JAK1KDM4AKDM4BKDM5C
SCHEMBL29567624 0.84 GRM4 (0.35) JAK2JAK1KDM4AKDM4BKDM5C
SCHEMBL22736286 0.83 GRM4 (0.34) JAK2JAK1GRM4
SCHEMBL29567090 0.83 GRM4 (0.34) JAK2JAK1GRM4
SCHEMBL29567608 0.81 GRM4 (0.34) JAK2JAK1KDM4AKDM4BKDM5C
SCHEMBL22736006 0.80 GRM4 (0.36) JAK2JAK1KDM4AKDM4BKDM5C

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-2020240586-A1 NOVEL COMPOUNDS FOR INHIBITION OF JANUS KINASE 1 MANKIND PHARMA LTD. (IN) 2020-12-03 — — WO disclosed
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