SCHEMBL25167695

SCHEMBL25167695

CCc1cc(Nc2nccn3c(-c4ccc(OC(F)F)c(F)c4F)cnc23)ccc1C(=O)N1CCN(C(=O)C2CCN(C(=O)O)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 11/20 0.40
▸ JAK2 O60674 4/20 0.35
▸ JAK1 P23458 4/20 0.35
▸ LCK P06239 5/20 0.34
▸ AURKB Q96GD4 5/20 0.34
▸ TTK P33981 2/20 0.33
▸ SMO Q99835 1/20 0.33
▸ MAPKAPK5 Q8IW41 1/20 0.33
▸ ERBB2 P04626 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
SCHEMBL25173549 1.00 PTK6 (0.40) PTK6JAK2JAK1LCKAURKB
SCHEMBL25175998 0.95 PTK6 (0.43) PTK6LCKAURKBTTKMAPKAPK5
SCHEMBL25173592 0.94 PTK6 (0.40) PTK6JAK2JAK1LCKAURKB
SCHEMBL25176078 0.94 PTK6 (0.42) PTK6JAK2JAK1LCKAURKB
SCHEMBL22153365 0.93 PTK6 (0.48) PTK6JAK2JAK1LCKAURKB
SCHEMBL25170322 0.93 PTK6 (0.37) PTK6JAK2JAK1LCKAURKB
SCHEMBL25170405 0.92 PTK6 (0.38) PTK6JAK2JAK1
SCHEMBL30386118 0.92 PTK6 (0.38) PTK6JAK2JAK1
SCHEMBL30386112 0.92 PTK6 (0.38) PTK6JAK2JAK1
SCHEMBL25170424 0.92 PTK6 (0.41) PTK6JAK2JAK1LCKAURKB

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-20230141600-A1 IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-05-11 — — 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-20230141600-A1 IMIDAZOPYRAZINE DERIVATIVES IKZF3, RRP15, IK PTK6 925/4885JAK2 57/4885JAK1 127/4885

“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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