SCHEMBL21252435

SCHEMBL21252435

CCc1c(OC)cc(OC)c(Cl)c1-c1cc2cnc(N)nc2c(N2CC(C)(O)C2)n1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 5/20 0.38
▸ JAK1 P23458 5/20 0.38
▸ TYK2 P29597 5/20 0.38
▸ JAK3 P52333 5/20 0.38
▸ KDR P35968 3/20 0.38
▸ AURKB Q96GD4 3/20 0.38
▸ FGFR1 P11362 8/20 0.36
▸ FGFR2 P21802 4/20 0.36
▸ FGFR4 P22455 3/20 0.35
▸ TTK P33981 1/20 0.34
▸ P2RX3 P56373 1/20 0.32
▸ P2RX2 Q9UBL9 1/20 0.32
▸ FGFR3 P22607 1/20 0.32
▸ PDCD1 Q15116 1/20 0.31
▸ CD274 Q9NZQ7 1/20 0.31

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
SCHEMBL21252289 0.93 MAP3K12 (0.37) JAK2JAK1TYK2JAK3KDR
SCHEMBL24488267 0.93 JAK2 (0.37) JAK2JAK1TYK2JAK3KDR
SCHEMBL21252266 0.91 JAK2 (0.36) JAK2JAK1TYK2JAK3KDR
SCHEMBL21252520 0.90 JAK2 (0.38) JAK2JAK1TYK2JAK3KDR
SCHEMBL21252085 0.88 TTK (0.38) JAK2JAK1TYK2JAK3KDR
SCHEMBL21252258 0.87 NOS1 (0.42) JAK2JAK1TYK2JAK3KDR
SCHEMBL21251864 0.85 FGFR4 (0.40) JAK2JAK1TYK2JAK3FGFR1
SCHEMBL24488291 0.85 TTK (0.36) JAK2JAK1TYK2JAK3KDR
SCHEMBL21252424 0.85 TTK (0.39) JAK2JAK1TYK2JAK3KDR
SCHEMBL21252208 0.85 TTK (0.38) 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
EP-3524603-A1 FGFR4 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2019-08-14 — — EP disclosed
Send feedback