SCHEMBL25753624

SCHEMBL25753624

COC(=O)C[C@H](N[S+]([O-])C(C)(C)C)c1cc(OC(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.33
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
FFAR1 O14842 1/20 0.31
FPR2 P25090 1/20 0.30

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
SCHEMBL24036890 1.00 EPHX2 (0.33) EPHX2MEN1LMNAMAPTHTT
SCHEMBL25753641 0.91 EPHX2 (0.32) EPHX2MAPTHTT
SCHEMBL24036536 0.91 EPHX2 (0.32) EPHX2MAPTHTT
SCHEMBL25753558 0.90 RXRA (0.37) EPHX2MEN1LMNAHTTKMT2A
SCHEMBL25622766 0.90 RXRA (0.37) EPHX2MEN1LMNAHTTKMT2A
SCHEMBL24036736 0.89 TACR1 (0.34) MAPT
SCHEMBL25622767 0.89 TACR1 (0.34) MAPT
SCHEMBL25753566 0.89 TACR1 (0.34) MAPT
SCHEMBL24036896 0.86 MEN1 (0.32) EPHX2MEN1LMNAMAPTKMT2A
SCHEMBL24036884 0.86 BACE1 (0.31) EPHX2MEN1KMT2A

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 EPHX2 3021/4885MEN1 431/4885LMNA 4654/4885

“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.