SCHEMBL14004604

SCHEMBL14004604

C=CS(=O)(=O)CCNc1nc(NCCCOC)c(C#N)c(C)c1/N=N/c1cc(OC)c(S(=O)(=O)C=C)cc1OC

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ KDM4E B2RXH2 4/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ HPGD P15428 1/20 0.30
▸ RXFP1 Q9HBX9 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
SCHEMBL14004595 1.00 TP53 (0.32) TP53GAAMAPTSMN1; SMN2KDM4E
SCHEMBL14004630 0.95 KMT2A (0.32) GAASMN1; SMN2
SCHEMBL14004614 0.95 MAPT (0.33) TP53GAAMAPTSMN1; SMN2KDM4E
SCHEMBL14004607 0.95 MAPT (0.33) TP53GAAMAPTSMN1; SMN2KDM4E
SCHEMBL14004599 0.89 PRMT1 (0.40) TP53GAAMAPTSMN1; SMN2KDM4E
SCHEMBL14004608 0.89 PRMT1 (0.40) TP53GAAMAPTSMN1; SMN2KDM4E
SCHEMBL14004613 0.84 PRMT1 (0.36) MAPTKDM4EALDH1A1HPGDRXFP1
SCHEMBL14004615 0.84 PRMT1 (0.36) MAPTKDM4EALDH1A1HPGDRXFP1
SCHEMBL14004589 0.82 KDM4E (0.34) MAPTSMN1; SMN2KDM4EALDH1A1RXFP1
SCHEMBL14004584 0.82 KDM4E (0.34) MAPTSMN1; SMN2KDM4EALDH1A1RXFP1

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 3 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
WO-2007006594-A2 REACTIVE AZO DYES, METHODS FOR THE PRODUCTION THEREOF AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-01-18 — — WO 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 TP53 914/4885GAA 3543/4885MAPT 3286/4885

“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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