SCHEMBL24036583

SCHEMBL24036583

COC(=O)C[C@H](NC(=O)CN)c1cc(-n2cccn2)cc(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.37
LMNA P02545 2/20 0.34
THRB P10828 1/20 0.33
KAT6A Q92794 6/20 0.33
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
DGAT1 O75907 2/20 0.32
ITGB3 P05106 1/20 0.32
ITGB1 P05556 1/20 0.32
ITGAV P06756 1/20 0.32
ITGA5 P08648 1/20 0.32
ITGB5 P18084 1/20 0.32
ITGB6 P18564 1/20 0.32
ITGB8 P26012 1/20 0.32
ITGA8 P53708 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
POLB P06746 1/20 0.32
TACR1 P25103 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
SCHEMBL30388833 0.85 ITGB3 (0.34) CNR1THRBDGAT1ITGB3ITGB1
SCHEMBL25754323 0.85 ITGB3 (0.34) CNR1THRBDGAT1ITGB3ITGB1
SCHEMBL25625471 0.84 KAT6A (0.36) LMNAKAT6AMAPTRAB9A
SCHEMBL25754244 0.83 LMNA (0.47) LMNAKAT6ARAB9A
SCHEMBL25625086 0.82 TACR1 (0.39) LMNATHRBITGB3ITGB1ITGAV
SCHEMBL24036837 0.78 ITGB3 (0.45) THRBMAPTITGB3ITGB1ITGAV
SCHEMBL24036843 0.78 ITGB3 (0.35) THRBITGB3ITGB1ITGAVITGA5
SCHEMBL25625085 0.78 THRB (0.36) LMNATHRBITGB3ITGB1ITGAV
SCHEMBL24036842 0.78 NOTUM (0.44) THRBITGB3ITGB1ITGAVITGA5
SCHEMBL24036845 0.78 THRB (0.40) LMNATHRBITGB3ITGB1ITGAV

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 CNR1 619/4885LMNA 4654/4885THRB 1803/4885

“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.