SCHEMBL30171998

SCHEMBL30171998

Cc1cc(Nc2nccn3c(-c4ccc(OC(F)F)cc4)cnc23)ccc1C(=O)N1CCN(CCN)CC1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 11/20 0.47
▸ LCK P06239 3/20 0.44
▸ MAPKAPK5 Q8IW41 2/20 0.41
▸ TTK P33981 6/20 0.41
▸ AURKB Q96GD4 4/20 0.41
▸ DRD2 P14416 1/20 0.39
▸ DRD3 P35462 1/20 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
SCHEMBL22124129 1.00 PTK6 (0.47) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL22124200 0.93 PTK6 (0.47) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL22124515 0.92 PTK6 (0.47) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL24870869 0.91 PTK6 (0.48) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL30177848 0.91 PTK6 (0.48) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL22142735 0.91 PTK6 (0.50) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL22124239 0.91 PTK6 (0.45) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL22124869 0.91 PTK6 (0.46) PTK6LCKMAPKAPK5TTKAURKB
Hydrochloric Acid SCHEMBL30171618 0.91 PTK6 (0.47) PTK6LCKMAPKAPK5TTKAURKB
SCHEMBL22125054 0.91 PTK6 (0.49) PTK6LCKMAPKAPK5TTKAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230022724-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-26 — — US disclosed
US-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 — — US disclosed
US-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-19 — — US disclosed
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2023-01-12 — — US disclosed
US-20230011869-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 (5 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-20230022724-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PTK6 2201/4885LCK 2427/4885MAPKAPK5 728/4885
US-20230011869-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PTK6 2201/4885LCK 2427/4885MAPKAPK5 728/4885
US-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PTK6 2141/4885LCK 2521/4885MAPKAPK5 695/4885
US-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES IL4, RPS4Y1, RPS4X PTK6 1818/4885LCK 2006/4885MAPKAPK5 516/4885
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 PTK6 2211/4885LCK 2521/4885MAPKAPK5 647/4885

“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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