SCHEMBL25754244

SCHEMBL25754244

COC(=O)C[C@H](NC(=O)CN)c1cccc(-n2cccn2)c1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.47
WDR5 P61964 1/20 0.40
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39
RAB9A P51151 1/20 0.39
KAT6A Q92794 2/20 0.38
SYK P43405 3/20 0.38
GLS O94925 2/20 0.37
DGAT2 Q96PD7 1/20 0.36
CTSD P07339 1/20 0.36
BACE1 P56817 1/20 0.36
TACR3 P29371 1/20 0.36
LRRK2 Q5S007 1/20 0.36

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
SCHEMBL25625471 0.84 KAT6A (0.36) LMNAWDR5RAB9AKAT6A
SCHEMBL24036583 0.83 CNR1 (0.37) LMNARAB9AKAT6A
SCHEMBL24036830 0.83 GFER (0.38) LMNAWDR5RAB9AGLSDGAT2
SCHEMBL24037115 0.82 LMNA (0.49) LMNAHCRTR1HCRTR2RAB9AKAT6A
SCHEMBL24036729 0.80 MAPT (0.42) WDR5KAT6ADGAT2TACR3
SCHEMBL25753678 0.79 LMNA (0.40) LMNAWDR5HCRTR1HCRTR2RAB9A
SCHEMBL24036981 0.79 LMNA (0.40) LMNAWDR5HCRTR1HCRTR2RAB9A
SCHEMBL24036552 0.77 CYP3A4 (0.46)
SCHEMBL24036727 0.76 KCNA5 (0.47) WDR5TACR3
SCHEMBL24036950 0.76 TACR3 (0.39) WDR5RAB9ATACR3

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 LMNA 4654/4885WDR5 2145/4885HCRTR1 1562/4885

“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.