SCHEMBL14004445

SCHEMBL14004445

C=CS(=O)(=O)CCNc1nc(NCCCOC)c(/N=N/c2sc(C#N)c(C)c2C#N)c(C)c1C#N

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 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
SCHEMBL14004448 1.00 KDM4E (0.30) KDM4EALDH1A1
SCHEMBL14004395 0.88 KDM4E (0.31) KDM4EALDH1A1
SCHEMBL14004394 0.88 — —
SCHEMBL14004600 0.82 KDM4E (0.35) KDM4EALDH1A1
SCHEMBL14004596 0.82 KDM4E (0.35) KDM4EALDH1A1
SCHEMBL14004450 0.81 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL14004458 0.81 KDM4E (0.32) KDM4EALDH1A1
SCHEMBL14004597 0.80 KMT2A (0.35) KDM4EALDH1A1
SCHEMBL13904473 0.79 ADORA2A (0.40) KDM4EALDH1A1
SCHEMBL14004604 0.79 TP53 (0.32) KDM4EALDH1A1

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 KDM4E 390/4885ALDH1A1 284/4885

“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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