SCHEMBL25752955

SCHEMBL25752955

COC(=O)c1cc([N+](=O)[O-])c2c(Cl)n[nH]c2c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 2/20 0.45
MAPK1 P28482 2/20 0.45
VCAM1 P19320 1/20 0.43
LMNA P02545 3/20 0.41
TPMT P51580 1/20 0.40
MAP2K4 P45985 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RECQL P46063 1/20 0.38
HPGD P15428 3/20 0.38
ALDH1A1 P00352 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
HTT P42858 1/20 0.37
RAF1 P04049 1/20 0.37
GFER P55789 1/20 0.37
PAX8 Q06710 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
SCHEMBL5221839 0.76 MAPT (0.47) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL645817 0.76 VCAM1 (0.55) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL5217141 0.74 NOS1 (0.48) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL70813 0.72 MAPT (0.63) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL30159180 0.72 MAPT (0.52) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL22081923 0.72 MAPT (0.52) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL24036773 0.72 NPC1 (0.42) MAPTKDM4EPOLBLMNAMAP2K4
SCHEMBL5217731 0.71 MAPT (0.47) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL989006 0.71 VCAM1 (0.56) MAPTKDM4EPOLBMAPK1VCAM1
SCHEMBL5924211 0.71 ESR1 (0.57) MAPTKDM4EPOLBVCAM1LMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250049806-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME UBE CORP (JP) 2025-02-13 US disclosed
EP-4431098-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME UBE Corporation (JP) 2024-09-18 EP disclosed
CN-115551846-B 1,4,5, 6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2024-03-08 CN disclosed
US-20230192661-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE UBE CORPORATION (JP) 2023-06-22 US disclosed
US-20230192661-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE UBE CORPORATION (JP) 2023-06-22 US disclosed
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
EP-4151632-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE UBE Corporation (JP) 2023-03-22 EP disclosed
CN-115551846-A 1,4,5,6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2022-12-30 CN 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 (2 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 MAPT 3157/4885KDM4E 1887/4885POLB 860/4885
US-20250049806-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME CYP21A2, HSD11B2, MC2R MAPT 2014/4885KDM4E 4332/4885POLB 4234/4885

“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.