SCHEMBL16817232

SCHEMBL16817232

C=CC(=O)Nc1cccc(-c2cc3nccc(Oc4cccc5cccnc45)c3o2)c1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 3/20 0.43
▸ EGFR P00533 7/20 0.42
▸ BTK Q06187 5/20 0.42
▸ PLCG1 P19174 3/20 0.41
▸ HSP90AA1 P07900 1/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ TYK2 P29597 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TDP2 O95551 1/20 0.38
▸ FGFR4 P22455 1/20 0.38

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
SCHEMBL723514 0.87 EGFR (0.47) JAK3EGFRBTKPLCG1TDP2
SCHEMBL723785 0.84 BTK (0.56) JAK3EGFRBTKPLCG1
SCHEMBL722213 0.83 BTK (0.59) JAK3EGFRBTK
SCHEMBL723014 0.83 EGFR (0.58) JAK3EGFRBTK
SCHEMBL722390 0.82 BTK (0.49) JAK3EGFRBTK
SCHEMBL722377 0.81 EGFR (0.49) JAK3EGFRBTKFGFR4
SCHEMBL723264 0.77 PLCG1 (0.51) JAK3EGFRBTKPLCG1
SCHEMBL721787 0.77 TGM2 (0.52) JAK3EGFRBTK
SCHEMBL723354 0.74 EGFR (0.45) EGFRBTKPLCG1FGFR4
SCHEMBL721852 0.73 BTK (0.47) JAK3EGFRBTKJAK2TYK2

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-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 — — EP claimed
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