SCHEMBL30168207

SCHEMBL30168207

CCc1cc(Nc2nccn3c(-c4ccc(OC)c(F)c4F)cnc23)ccc1C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 2/20 0.39
▸ SYK P43405 6/20 0.38
▸ PTK2 Q05397 5/20 0.37
▸ MAPKAPK5 Q8IW41 1/20 0.37
▸ KDR P35968 1/20 0.36
▸ PDE4B Q07343 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ TTK P33981 3/20 0.35
▸ AURKB Q96GD4 1/20 0.34
▸ ZAP70 P43403 1/20 0.34
▸ KARS1 Q15046 1/20 0.34

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
SCHEMBL22123373 1.00 PTK6 (0.39) PTK6SYKPTK2MAPKAPK5KDR
SCHEMBL30385532 0.97 PTK6 (0.37) PTK6SYKPTK2MAPKAPK5KDR
SCHEMBL30386042 0.95 PTK6 (0.37) PTK6SYKPTK2MAPKAPK5KDR
SCHEMBL22123142 0.93 PTK6 (0.39) PTK6SYKMAPKAPK5PDE4BPDE4D
SCHEMBL30168175 0.93 PTK6 (0.39) PTK6SYKMAPKAPK5PDE4BPDE4D
SCHEMBL24940106 0.93 SYK (0.44) PTK6SYKMAPKAPK5KDRPDE4B
Hydrochloric Acid SCHEMBL22124453 0.93 PTK6 (0.39) PTK6SYKMAPKAPK5PDE4BPDE4D
Hydrochloric Acid SCHEMBL30386239 0.93 PTK6 (0.39) PTK6SYKMAPKAPK5PDE4BPDE4D
SCHEMBL22123485 0.92 PTK6 (0.39) PTK6SYKPTK2MAPKAPK5PDE4B
SCHEMBL24916600 0.92 PTK2 (0.39) PTK6SYKPTK2MAPKAPK5TTK

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
CN-115667264-A Novel imidazo-pyrazine derivatives 豪夫迈·罗氏有限公司 2023-01-31 — — CN disclosed
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