SCHEMBL24036727

SCHEMBL24036727

COC(=O)C[C@H](NC(=O)CN)c1cccc(Br)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 2/20 0.47
POLB P06746 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.41
CYP26A1 O43174 1/20 0.40
TACR3 P29371 1/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
F7 P08709 2/20 0.38
F2 P00734 1/20 0.38
WDR5 P61964 1/20 0.37

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
SCHEMBL25625286 0.87 POLB (0.42) KCNA5POLBMEN1KMT2ATACR3
SCHEMBL24036731 0.85 WDR5 (0.50) MEN1KMT2ATACR3ALDH1A1WDR5
SCHEMBL24036950 0.85 TACR3 (0.39) KCNA5POLBMEN1KMT2ATACR3
SCHEMBL24036947 0.82 L3MBTL1 (0.40) KCNA5MEN1KMT2ATACR3MAPT
SCHEMBL25754069 0.82 POLB (0.39) KCNA5POLBMEN1KMT2ATACR3
SCHEMBL24036757 0.82 POLB (0.39) KCNA5POLBMEN1KMT2ATACR3
SCHEMBL25625540 0.81 PNMT (0.46) POLBMEN1KMT2AHTTNPSR1
SCHEMBL24036756 0.81 POLB (0.38) KCNA5POLBMEN1KMT2AHSD17B10
SCHEMBL24036726 0.81 ROCK2 (0.39) POLBKMT2ATACR3WDR5
SCHEMBL7358671 0.81 ALDH1A1 (0.48) MEN1KMT2ACYP26A1ALDH1A1MAPT

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 KCNA5 1043/4885POLB 860/4885MEN1 431/4885

“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.