SCHEMBL20352048

SCHEMBL20352048

CN1CC(OC(=O)N2CCN(c3ccc(Br)c(NC(=O)c4coc(N)n4)c3)CC2)C1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PAICS P22234 7/20 0.40
▸ KCNH2 Q12809 2/20 0.38
▸ IRAK4 Q9NWZ3 2/20 0.38
▸ HDAC3 O15379 3/20 0.37
▸ HDAC2 Q92769 3/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ ADAM10 O14672 5/20 0.36
▸ ERBB2 P04626 5/20 0.36
▸ MMP2 P08253 5/20 0.36
▸ MMP3 P08254 4/20 0.36
▸ MMP9 P14780 4/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2C18 P33260 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36

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
SCHEMBL20352088 0.91 PAICS (0.48) PAICSMAPTSMN1; SMN2
SCHEMBL21571658 0.88 PAICS (0.50) PAICS
SCHEMBL24220529 0.86 PAICS (0.49) PAICSKCNH2IRAK4HDAC3HDAC2
SCHEMBL20352125 0.84 BACE1 (0.48) MAPTSMN1; SMN2
SCHEMBL20339036 0.84 PAICS (0.42) PAICSKCNH2HDAC3HDAC2
SCHEMBL20339072 0.82 PAICS (0.43) PAICSMAPTSMN1; SMN2
SCHEMBL20352021 0.81 PAICS (0.48) PAICSMAPTSMN1; SMN2
SCHEMBL21571648 0.80 PAICS (0.42) PAICSKCNH2IRAK4HDAC3HDAC2
SCHEMBL24220430 0.80 PIM1 (0.44) PAICSMAPTSMN1; SMN2
SCHEMBL20339037 0.80 PAICS (0.48) PAICSMAPT

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 6 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
WO-2018122549-A1 OXAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF CANCER LIFEARC (GB) 2018-07-05 — — WO 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 1/4885KCNH2 2442/4885IRAK4 3330/4885
US-10961233-B2 Oxazole derivatives for use in the treatment of cancer PAICS, CDK13, CDK12 PAICS 1/4885KCNH2 2703/4885IRAK4 3349/4885

“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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