SCHEMBL25753667

SCHEMBL25753667

COC(=O)C[C@H](N[S+]([O-])C(C)(C)C)c1cccc(C(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 12/20 0.37
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
TACR3 P29371 1/20 0.33
F2 P00734 2/20 0.33
F10 P00742 2/20 0.33
GRIN2B Q13224 1/20 0.32
PRSS1 P07477 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
SCHEMBL25623356 1.00 KCNA5 (0.37) KCNA5MAPTRAB9ATACR3F2
SCHEMBL24036741 0.88 KDM4E (0.38) KCNA5MAPTRAB9A
SCHEMBL25753665 0.88 KDM4E (0.38) KCNA5MAPTRAB9A
SCHEMBL25753660 0.86 MEN1 (0.40)
SCHEMBL25623349 0.86 MEN1 (0.40)
SCHEMBL25753673 0.86 WDR5 (0.43)
SCHEMBL25753676 0.86 KCNA5 (0.47) KCNA5MAPT
SCHEMBL24036985 0.86 KCNA5 (0.47) KCNA5MAPT
SCHEMBL24036979 0.86 WDR5 (0.43)
SCHEMBL31367054 0.85 KCNQ3 (0.34) KCNA5MAPTRAB9ATACR3F2

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 KCNA5 1043/4885MAPT 3157/4885RAB9A 905/4885

“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.