SCHEMBL30171908

SCHEMBL30171908

CCc1cc(Nc2nccn3c(-c4ccc(OC)c(F)c4F)cnc23)ccc1C(=O)NCC(=O)NCCN1CCC1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 1/20 0.36
▸ POLR1A O95602 1/20 0.35
▸ ALK Q9UM73 2/20 0.34
▸ AXL P30530 5/20 0.34
▸ MAPKAPK5 Q8IW41 1/20 0.34
▸ FGFR3 P22607 1/20 0.34
▸ MCHR1 Q99705 2/20 0.33
▸ MCHR2 Q969V1 1/20 0.33
▸ TTK P33981 3/20 0.33
▸ EGFR P00533 1/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ PTK2 Q05397 1/20 0.33
▸ CCNT1 O60563 1/20 0.32
▸ CDK9 P50750 1/20 0.32

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
SCHEMBL22123369 1.00 PTK6 (0.36) PTK6POLR1AALKAXLMAPKAPK5
SCHEMBL30171808 0.91 PTK6 (0.35) PTK6AXLMAPKAPK5TTK
SCHEMBL22123448 0.91 PTK6 (0.35) PTK6AXLMAPKAPK5TTK
SCHEMBL22122984 0.91 SYK (0.36) PTK6AXLMAPKAPK5TTK
SCHEMBL30171593 0.91 SYK (0.36) PTK6AXLMAPKAPK5TTK
SCHEMBL22123242 0.91 PTK6 (0.34) PTK6AXLMAPKAPK5TTK
SCHEMBL30171810 0.91 PTK6 (0.34) PTK6AXLMAPKAPK5TTK
SCHEMBL22123078 0.90 PTK6 (0.43) PTK6MAPKAPK5FGFR3TTKEGFR
SCHEMBL30171622 0.90 PTK6 (0.43) PTK6MAPKAPK5FGFR3TTKEGFR
SCHEMBL22122846 0.89 CDK2 (0.38) PTK6ALKAXLFGFR3MCHR1

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
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 PTK6 2211/4885POLR1A 557/4885ALK 1026/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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