SCHEMBL24870939

SCHEMBL24870939

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)NCCN1C[C@@H](C)O[C@@H](C)C1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 16/20 0.46
▸ CNR2 P34972 2/20 0.38
▸ PTK6 Q13882 1/20 0.37
▸ MAPKAPK5 Q8IW41 1/20 0.37

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
SCHEMBL30172083 1.00 TTK (0.46) TTKCNR2PTK6MAPKAPK5
SCHEMBL22124915 0.89 CNR2 (0.46) TTKCNR2MAPKAPK5
SCHEMBL30171596 0.88 TTK (0.40) TTKCNR2PTK6MAPKAPK5
SCHEMBL24870981 0.88 TTK (0.40) TTKCNR2PTK6MAPKAPK5
SCHEMBL22122960 0.88 PTK6 (0.47) TTKPTK6MAPKAPK5
SCHEMBL22123451 0.86 TTK (0.48) TTKPTK6MAPKAPK5
SCHEMBL22123095 0.85 TTK (0.45) TTKPTK6MAPKAPK5
SCHEMBL22123836 0.85 KDR (0.45) TTKCNR2MAPKAPK5
SCHEMBL22123104 0.85 CNR2 (0.44) TTKCNR2MAPKAPK5
SCHEMBL30177664 0.84 TTK (0.43) TTKPTK6

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 TTK 4482/4885CNR2 2484/4885PTK6 2211/4885

“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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