SCHEMBL25752918

SCHEMBL25752918

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

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.37
TNF P01375 2/20 0.35
GPR139 Q6DWJ6 1/20 0.35
MAPT P10636 4/20 0.34
RAB9A P51151 1/20 0.34
KCNA5 P22460 2/20 0.34
PNP P00491 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
GPR35 Q9HC97 1/20 0.33
LMNA P02545 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 2/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32
WDR5 P61964 1/20 0.32
SMN1; SMN2 Q16637 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
Hydrochloric Acid SCHEMBL30389457 0.99 L3MBTL1 (0.36) L3MBTL1TNFGPR139MAPTRAB9A
SCHEMBL20154370 0.89 L3MBTL1 (0.45) L3MBTL1TNFMAPTRAB9APNP
SCHEMBL25623852 0.89 KCNA5 (0.37) L3MBTL1TNFMAPTRAB9AKCNA5
SCHEMBL20154369 0.89 L3MBTL1 (0.45) L3MBTL1TNFMAPTRAB9APNP
SCHEMBL6341030 0.89 L3MBTL1 (0.45) L3MBTL1TNFMAPTRAB9APNP
SCHEMBL24036698 0.89 KCNA5 (0.37) L3MBTL1TNFMAPTRAB9AKCNA5
SCHEMBL31089014 0.86 GPR35 (0.40) L3MBTL1GPR139MAPTMEN1KMT2A
Hydrochloric Acid SCHEMBL6227452 0.85 GPR35 (0.39) L3MBTL1GPR139MAPTMEN1KMT2A
SCHEMBL25753711 0.84 L3MBTL1 (0.38) L3MBTL1TNFMAPTRAB9AKCNA5
SCHEMBL23380670 0.84 GPR139 (0.38) L3MBTL1TNFGPR139MAPTRAB9A

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 2 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
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 4836/4885GPR139 676/4885

“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.