SCHEMBL24036717

SCHEMBL24036717

COC(=O)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)c1cc(OC(F)(F)F)ccc1F

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KCNQ3 O43525 1/20 0.39
KCNQ2 O43526 1/20 0.39
GPR139 Q6DWJ6 4/20 0.38
ITGB3 P05106 1/20 0.35
ITGAV P06756 1/20 0.35
ITGB5 P18084 1/20 0.35
ITGB6 P18564 1/20 0.35
EGFR P00533 1/20 0.35
AURKB Q96GD4 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.34
PTPRB P23467 1/20 0.34
RIPK1 Q13546 5/20 0.33
BACE1 P56817 1/20 0.33
PDK2 Q15119 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
PDE2A O00408 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
SCHEMBL24036716 0.91 EGFR (0.35) EGFRAURKBPTPRBPDK2SMN1; SMN2
SCHEMBL25624299 0.86 CTSA (0.39) GPR139EGFRAURKBPTPRBSMN1; SMN2
SCHEMBL24036812 0.86 EGFR (0.40) EGFRAURKBPTPRBMEN1KMT2A
SCHEMBL24036815 0.85 AAK1 (0.42) EGFRAURKBPTPRBSMN1; SMN2
SCHEMBL24036750 0.84 GPR139 (0.50) KCNQ3KCNQ2GPR139ITGB3ITGAV
SCHEMBL24036745 0.83 PDE2A (0.36) GPR139ITGB3ITGAVITGB5ITGB6
SCHEMBL24036714 0.83 ITGB3 (0.43) KCNQ3KCNQ2GPR139ITGB3ITGAV
SCHEMBL24036949 0.83 RIPK1 (0.40) GPR139MRGPRX4RIPK1BACE1MEN1
SCHEMBL24036715 0.81 ITGB3 (0.43) KCNQ3KCNQ2GPR139ITGB3ITGAV
SCHEMBL24036577 0.78 RORC (0.36) EGFRAURKBPTPRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192661-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE UBE CORPORATION (JP) 2023-06-22 US disclosed
WO-2023085396-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME UBE株式会社 2023-05-19 WO disclosed
WO-2021230325-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE 宇部興産株式会社 2021-11-18 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 (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-20230192661-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE DHFR, DPYD, CYP2D6 KCNQ3 1839/4885KCNQ2 1362/4885GPR139 676/4885

“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.