SCHEMBL21571655

SCHEMBL21571655

CCN(CC)CC(C)CS(=O)(=O)N1CCN(c2ccc(Br)c(NC(=O)c3coc(N)n3)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PAICS P22234 17/20 0.35
▸ PTGDR Q13258 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL21571621 0.92 PAICS (0.38) PAICSPTGDR
SCHEMBL20351996 0.90 PAICS (0.37) PAICSPTGDRALDH1A1MAPTNPSR1
SCHEMBL21571635 0.89 PAICS (0.39) PAICSPTGDRALDH1A1MAPTNPSR1
SCHEMBL21571663 0.88 PAICS (0.37) PAICSPTGDR
SCHEMBL20339045 0.88 PAICS (0.38) PAICSPTGDR
SCHEMBL20339059 0.87 PAICS (0.37) PAICSPTGDR
SCHEMBL21571654 0.86 GHSR (0.38) PAICS
SCHEMBL20352151 0.83 PAICS (0.42) PAICSPTGDR
SCHEMBL20352137 0.83 PAICS (0.43) PAICS
SCHEMBL21571640 0.82 PAICS (0.42) PAICS

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
EP-3562824-B1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2022-01-26 — — EP disclosed
US-10961233-B2 Oxazole derivatives for use in the treatment of cancer LIFEARC (GB) 2021-03-30 — — US disclosed
US-10961233-B2 Oxazole derivatives for use in the treatment of cancer LIFEARC (GB) 2021-03-30 — — US disclosed
US-20190352295-A1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2019-11-21 — — US disclosed
US-20190352295-A1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2019-11-21 — — 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 (2 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-20190352295-A1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER PAICS, CDK12, CDK13 PAICS 1/4885PTGDR 316/4885ALDH1A1 1713/4885
US-10961233-B2 Oxazole derivatives for use in the treatment of cancer PAICS, CDK13, CDK12 PAICS 1/4885PTGDR 261/4885ALDH1A1 1593/4885

“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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