SCHEMBL29692179

SCHEMBL29692179

CN1C[C@H]2C[C@@H]1CN2c1ccn2nc(-c3ccccc3F)c(C(=O)N[C@H]3N=C(c4ccccc4)c4cccc(F)c4NC3=O)c2n1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ NOTCH1 P46531 10/20 0.43
▸ RBPJ Q06330 6/20 0.43
▸ NOTCH3 Q9UM47 4/20 0.39
▸ CCKBR P32239 6/20 0.38
▸ CCKAR P32238 5/20 0.38
▸ CBLB Q13191 3/20 0.38

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
SCHEMBL23013341 1.00 NOTCH1 (0.43) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL23013479 0.86 NOTCH1 (0.43) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL29692237 0.86 NOTCH1 (0.43) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL30029552 0.85 NOTCH1 (0.45) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL29692200 0.80 CCKBR (0.45) NOTCH1RBPJCCKBRCCKAR
SCHEMBL23013106 0.80 CCKBR (0.45) NOTCH1RBPJCCKBRCCKAR
SCHEMBL23013700 0.80 NOTCH1 (0.43) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL23013261 0.80 NOTCH1 (0.43) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL29692189 0.80 NOTCH1 (0.43) NOTCH1RBPJNOTCH3CCKBRCCKAR
SCHEMBL23013825 0.80 CCKBR (0.44) NOTCH1RBPJNOTCH3CCKBRCCKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12227507-B2 Pharmaceutical compounds PFIZER INC. (US) 2025-02-18 — — US claimed
EP-4017856-A1 PHARMACEUTICAL COMPOUNDS Reviral Limited (GB) 2022-06-29 — — EP claimed
CN-114555604-B Pharmaceutical compounds 辉瑞公司 2024-11-15 — — CN disclosed
EP-4017856-A1 PHARMACEUTICAL COMPOUNDS Reviral Limited (GB) 2022-06-29 — — EP 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-12227507-B2 Pharmaceutical compounds CHRNA6, GABRA6, CHRNA7 NOTCH1 4608/4885RBPJ 1110/4885NOTCH3 4553/4885

“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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