SCHEMBL25753711

SCHEMBL25753711

COC(=O)C[C@H](N)c1cc(C)cc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
TNF P01375 2/20 0.36
CTSA P10619 2/20 0.35
MAPT P10636 4/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 3/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SLC7A5 Q01650 1/20 0.34
HTT P42858 1/20 0.34
PNP P00491 1/20 0.34
LMNA P02545 1/20 0.33
SCN4A P35499 2/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL20154370 0.91 L3MBTL1 (0.45) L3MBTL1TNFMAPTRAB9AALDH1A1
SCHEMBL6341030 0.91 L3MBTL1 (0.45) L3MBTL1TNFMAPTRAB9AALDH1A1
SCHEMBL20154369 0.91 L3MBTL1 (0.45) L3MBTL1TNFMAPTRAB9AALDH1A1
SCHEMBL20158191 0.89 HTT (0.38) TNFMAPTRAB9AALDH1A1SLC7A5
SCHEMBL24036704 0.84 L3MBTL1 (0.37) L3MBTL1TNFMAPTRAB9AALDH1A1
SCHEMBL25752918 0.84 L3MBTL1 (0.37) L3MBTL1TNFMAPTRAB9AALDH1A1
Hydrochloric Acid SCHEMBL30389457 0.82 L3MBTL1 (0.36) L3MBTL1TNFMAPTRAB9AALDH1A1
SCHEMBL24036703 0.82 MAPT (0.34) MAPTRAB9AALDH1A1GAASLC7A5
Hydrochloric Acid SCHEMBL19067170 0.81 CYP2C9 (0.40) CTSAMEN1KMT2ASMN1; SMN2LMNA
SCHEMBL25752836 0.80 SLC13A3 (0.40) L3MBTL1CTSAMAPTSMN1; SMN2LMNA

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 L3MBTL1 2036/4885TNF 4836/4885CTSA 4587/4885

“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.