SCHEMBL27008232

SCHEMBL27008232

N=C(S)NCCNC(=N)S

nearest known ligand 0.30

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL9749889 0.83
SCHEMBL1054328 0.81
Hydrochloric Acid SCHEMBL10944341 0.81
SCHEMBL9191057 0.81
SCHEMBL9076215 0.81
Bromide SCHEMBL9435928 0.78
Hydrochloric Acid SCHEMBL10656294 0.78
Hydrochloric Acid SCHEMBL7527399 0.78
SCHEMBL7063422 0.76
SCHEMBL10878067 0.76

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-20240018230-A1 METHODS FOR TREATING OR MODULATING AN INFLAMMATORY RESPONSE ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2024-01-18 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-20240018230-A1 METHODS FOR TREATING OR MODULATING AN INFLAMMATORY RESPONSE IFNG, TNF, IL2 ALDH1A1 4548/4885CYP2C9 4147/4885HPGD 786/4885

“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.