SCHEMBL25753619

SCHEMBL25753619

COC(=O)C[C@H](N[S+]([O-])C(C)(C)C)c1cc(Cl)ccc1F

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FDFT1 P37268 1/20 0.37
CTSA P10619 6/20 0.37
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35
APH1A Q96BI3 1/20 0.35
PSENEN Q9NZ42 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
EGFR P00533 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 1/20 0.32
WDR5 P61964 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32

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
SCHEMBL24036882 1.00 FDFT1 (0.37) FDFT1CTSAPSEN1PSEN2APH1B
SCHEMBL25752818 0.88 CTSA (0.35) CTSAMAPTSMN1; SMN2HTTLMNA
SCHEMBL25753621 0.87 MEN1 (0.34) MEN1KMT2AEGFRHTTLMNA
SCHEMBL24036886 0.87 MEN1 (0.34) MEN1KMT2AEGFRHTTLMNA
SCHEMBL24036721 0.86 CTSA (0.38) CTSAMEN1KMT2AMAPT
SCHEMBL25753581 0.86 CTSA (0.38) CTSAMEN1KMT2AMAPT
SCHEMBL24036537 0.85 EPHX2 (0.35) MEN1KMT2AMAPTSMN1; SMN2HTT
SCHEMBL25753637 0.85 EPHX2 (0.35) MEN1KMT2AMAPTSMN1; SMN2HTT
SCHEMBL24036538 0.84 BACE1 (0.36) MEN1KMT2ASMN1; SMN2
SCHEMBL25753654 0.84 BACE1 (0.36) MEN1KMT2ASMN1; SMN2

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 1 patent. 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

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 FDFT1 2161/4885CTSA 4587/4885PSEN1 3871/4885

“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.