SCHEMBL22124307

SCHEMBL22124307

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N1CCN(C(=O)C2CC(N)C2)CC1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 13/20 0.47
▸ TTK P33981 5/20 0.41
▸ MAPKAPK5 Q8IW41 2/20 0.40
▸ AURKB Q96GD4 6/20 0.39
▸ LCK P06239 5/20 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
SCHEMBL24870732 1.00 PTK6 (0.47) PTK6TTKMAPKAPK5AURKBLCK
SCHEMBL24870844 1.00 PTK6 (0.47) PTK6TTKMAPKAPK5AURKBLCK
Hydrochloric Acid SCHEMBL22123512 0.99 PTK6 (0.46) PTK6TTKMAPKAPK5AURKBLCK
Hydrochloric Acid SCHEMBL30401935 0.99 PTK6 (0.46) PTK6TTKMAPKAPK5AURKBLCK
SCHEMBL22124987 0.92 PTK6 (0.48) PTK6TTKMAPKAPK5AURKBLCK
SCHEMBL22123953 0.92 PTK6 (0.50) PTK6TTKAURKBLCK
SCHEMBL30177974 0.91 PTK6 (0.48) PTK6TTKAURKBLCK
SCHEMBL22124976 0.91 PTK6 (0.53) PTK6TTKAURKBLCK
SCHEMBL28641813 0.91 PTK6 (0.46) PTK6TTKMAPKAPK5AURKBLCK
SCHEMBL22125054 0.91 PTK6 (0.49) PTK6TTKMAPKAPK5AURKBLCK

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3897839-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. Hoffmann-La Roche AG (CH) 2021-10-27 — — EP disclosed
CN-113226469-A Imidazopyrazine derivatives as antibacterial agents 豪夫迈·罗氏有限公司 2021-08-06 — — CN disclosed
CN-113195496-A Imidazopyrazine derivatives as antibacterial agents 豪夫迈·罗氏有限公司 2021-07-30 — — CN disclosed
CN-113195498-A Novel imidazopyrazine derivatives 豪夫迈·罗氏有限公司 2021-07-30 — — CN disclosed
CN-113195497-A Novel imidazopyrazine derivatives 豪夫迈·罗氏有限公司 2021-07-30 — — CN disclosed
CN-113164771-A Imidazopyrazine derivatives as antibacterial agents 豪夫迈·罗氏有限公司 2021-07-23 — — CN disclosed
WO-2020126952-A1 IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2020-06-25 — — WO disclosed
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