SCHEMBL25013067

SCHEMBL25013067

Cc1ccc(-c2cnc3c(Nc4ccc(C(=O)N(C)CC5(O)CCNCC5)c(C)c4)nccn23)cc1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 5/20 0.47
▸ TTK P33981 12/20 0.45
▸ AURKA O14965 1/20 0.40
▸ MAPKAPK5 Q8IW41 2/20 0.39

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
SCHEMBL22123409 0.90 PTK6 (0.44) PTK6TTKAURKAMAPKAPK5
SCHEMBL25014255 0.88 TTK (0.48) PTK6TTKMAPKAPK5
SCHEMBL25013246 0.86 TTK (0.48) PTK6TTKAURKAMAPKAPK5
SCHEMBL22123030 0.80 PTK6 (0.47) PTK6TTK
Hydrochloric Acid SCHEMBL30171859 0.80 PTK6 (0.47) PTK6TTK
SCHEMBL25013054 0.79 PTK6 (0.57) PTK6
SCHEMBL22122995 0.79 TTK (0.46) PTK6TTKAURKA
SCHEMBL25013086 0.79 PTK6 (0.54) PTK6TTK
SCHEMBL22122897 0.78 TTK (0.46) PTK6TTKMAPKAPK5
SCHEMBL25013102 0.78 TTK (0.53) PTK6TTK

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-3898631-B1 NOVEL IMIDAZOPYRAZINE DERIVATIVES AS ANTIBACTERIALS HOFFMANN LA ROCHE (CH) 2023-01-18 — — EP disclosed
Send feedback