SCHEMBL25211002

SCHEMBL25211002

Cn1c(=O)c2c(nc(SCc3cccc(Cl)c3)n2C)n(C)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAOA P21397 17/20 1.00
MAOB P27338 17/20 1.00
ALDH1A1 P00352 1/20 0.62
MAPT P10636 1/20 0.62
HTT P42858 1/20 0.62
NPSR1 Q6W5P4 1/20 0.62
RXFP1 Q9HBX9 1/20 0.60

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
SCHEMBL30423044 1.00 MAOA (1.00) MAOAMAOBALDH1A1MAPTHTT
SCHEMBL25236757 0.88 MAOB (0.78) MAOAMAOBALDH1A1MAPTHTT
SCHEMBL30422270 0.86 MAOB (1.00) MAOAMAOBRXFP1
SCHEMBL25223434 0.86 MAOB (0.76) MAOAMAOBALDH1A1RXFP1
SCHEMBL30422821 0.86 MAOB (0.76) MAOAMAOBALDH1A1RXFP1
SCHEMBL25234505 0.86 MAOB (1.00) MAOAMAOBRXFP1
SCHEMBL25228419 0.85 MAOB (1.00) MAOAMAOBALDH1A1MAPTHTT
SCHEMBL25206902 0.85 MAOB (1.00) MAOAMAOBALDH1A1MAPTHTT
SCHEMBL25238218 0.84 MAOB (0.82) MAOAMAOBALDH1A1RXFP1
SCHEMBL30422884 0.84 MAOB (0.82) MAOAMAOBALDH1A1RXFP1

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-11666577-B2 MLKL inhibitors NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2023-06-06 US disclosed
CN-110573509-A MLKL inhibitors 北京生命科学研究所 2019-12-13 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 (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-11666577-B2 MLKL inhibitors MLKL, CMKLR1, PCSK9 MAOA 4584/4885MAOB 4517/4885ALDH1A1 4376/4885

“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.