SCHEMBL30171566

SCHEMBL30171566

COc1ccc(-c2cnc3c(Nc4ccc(C(=O)NCCOCCN)c(Cl)c4)nccn23)c(F)c1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTK6 Q13882 2/20 0.41
▸ SYK P43405 2/20 0.36
▸ BCL6 P41182 5/20 0.35
▸ MAPKAPK5 Q8IW41 1/20 0.35
▸ IGF1R P08069 1/20 0.35
▸ EGFR P00533 3/20 0.34
▸ LRRK2 Q5S007 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34
▸ MCHR1 Q99705 1/20 0.34
▸ BCDIN3D Q7Z5W3 1/20 0.33
▸ HDAC3 O15379 1/20 0.33
▸ ERBB2 P04626 1/20 0.33
▸ HDAC4 P56524 1/20 0.33
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC7 Q8WUI4 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC10 Q969S8 1/20 0.33
▸ HDAC11 Q96DB2 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33

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
SCHEMBL22124604 1.00 PTK6 (0.41) PTK6SYKBCL6MAPKAPK5IGF1R
SCHEMBL22124871 0.94 SYK (0.39) PTK6SYKMAPKAPK5MCHR1
SCHEMBL22124653 0.94 SYK (0.39) PTK6SYKMAPKAPK5
SCHEMBL22124815 0.92 TTK (0.39) PTK6SYKMAPKAPK5
SCHEMBL22123511 0.92 PTK6 (0.41) PTK6IGF1REGFRMCHR1ERBB2
SCHEMBL30349525 0.92 SYK (0.36) PTK6SYKMAPKAPK5IGF1R
SCHEMBL22123578 0.92 SYK (0.36) PTK6SYKMAPKAPK5
Hydrochloric Acid SCHEMBL30193386 0.92 TTK (0.38) PTK6SYKMAPKAPK5
SCHEMBL22124567 0.92 SYK (0.36) PTK6SYKMAPKAPK5IGF1R
SCHEMBL30385354 0.92 SYK (0.36) PTK6SYKMAPKAPK5

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 2201/4885SYK 992/4885BCL6 3859/4885
US-20230011869-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PTK6 2201/4885SYK 992/4885BCL6 3859/4885
US-20230017532-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, O60361, MYD88 PTK6 2141/4885SYK 939/4885BCL6 3737/4885
US-20230013602-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES IL4, RPS4Y1, RPS4X PTK6 1818/4885SYK 868/4885BCL6 3557/4885
US-20230012368-A1 NOVEL IMIDAZOPYRAZINE DERIVATIVES MRPL21, MYD88, IL1R1 PTK6 2211/4885SYK 954/4885BCL6 4009/4885

“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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