SCHEMBL14004409

SCHEMBL14004409

C=CS(=O)(=O)c1ccc(CCNc2nc(NCCOS(=O)(=O)O)c(C#N)c(C)c2/N=N/c2ccc(-c3nc4ccc(C)c(S(=O)(=O)O)c4s3)cc2S(=O)(=O)O)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SNCA P37840 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ NT5E P21589 1/20 0.35
▸ CASP1 P29466 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ CASP7 P55210 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL14004411 1.00 APP (0.39) APPMAPTSNCAALDH1A1TP53
SCHEMBL14004415 0.83 CD40 (0.36) MAPTALDH1A1TP53GAAHPGD
SCHEMBL14004418 0.83 CD40 (0.36) MAPTALDH1A1TP53GAAHPGD
SCHEMBL14004298 0.73 CD40 (0.38) MAPTALDH1A1CASP1CASP7SMN1; SMN2
SCHEMBL14004632 0.72 PRMT1 (0.37) MAPTALDH1A1TP53CASP1CASP7
SCHEMBL13332735 0.71 MAPT (0.65) APPMAPTSNCAALDH1A1TP53
SCHEMBL13332765 0.71 MAPT (0.65) APPMAPTSNCAALDH1A1TP53
SCHEMBL14004293 0.70 CD40 (0.39) MAPTALDH1A1CASP1CASP7SMN1; SMN2
SCHEMBL14004613 0.70 PRMT1 (0.36) MAPTALDH1A1HPGDCASP1CASP7
SCHEMBL14004615 0.70 PRMT1 (0.36) MAPTALDH1A1HPGDCASP1CASP7

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-20080289124-A1 Reactive Azo Dyes, Methods for the Production Thereof and Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-11-27 — — US disclosed
US-20080289124-A1 Reactive Azo Dyes, Methods for the Production Thereof and Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-11-27 — — 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-20080289124-A1 Reactive Azo Dyes, Methods for the Production Thereof and Their Use IK, CYP1A1, ALKBH1 APP 1526/4885MAPT 3286/4885SNCA 3726/4885

“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.

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