SCHEMBL14004518

SCHEMBL14004518

C=CS(=O)(=O)CCNc1nc(NCCCC)c(/N=N/c2ccc(/N=N/c3ccc(S(=O)(=O)O)cc3)c3ccccc23)c(C)c1C#N

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLO1 Q04760 1/20 0.34
▸ KMT2A Q03164 6/20 0.34
▸ RPS6KA3 P51812 1/20 0.34
▸ MAPT P10636 5/20 0.34
▸ MEN1 O00255 5/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ PKM P14618 1/20 0.33
▸ TDP1 Q9NUW8 4/20 0.33
▸ THRB P10828 1/20 0.33
▸ SENP3 Q9H4L4 3/20 0.32
▸ SENP2 Q9HC62 3/20 0.32
▸ SENP1 Q9P0U3 3/20 0.32
▸ SUMO2 P61956 2/20 0.32
▸ SUMO1 P63165 2/20 0.32
▸ SENP7 Q9BQF6 2/20 0.32
▸ ATIC P31939 1/20 0.31
▸ CD40 P25942 1/20 0.31
▸ CD40LG P29965 1/20 0.31
▸ LMNA P02545 2/20 0.31

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
SCHEMBL14004513 1.00 GLO1 (0.34) GLO1KMT2ARPS6KA3MAPTMEN1
SCHEMBL14004526 0.92 KDM4E (0.34) GLO1KMT2ARPS6KA3MAPTMEN1
SCHEMBL14004528 0.92 KDM4E (0.34) GLO1KMT2ARPS6KA3MAPTMEN1
SCHEMBL14004451 0.91 CD40 (0.39) KMT2ARPS6KA3MAPTMEN1ALDH1A1
SCHEMBL14004468 0.91 CD40 (0.39) KMT2ARPS6KA3MAPTMEN1ALDH1A1
SCHEMBL14029561 0.90 CTRB1 (0.36) KMT2AMEN1ALDH1A1TDP1THRB
SCHEMBL14030074 0.90 CTRB1 (0.36) KMT2AMEN1ALDH1A1TDP1THRB
SCHEMBL14004527 0.88 MAPK8 (0.33) GLO1KMT2ARPS6KA3MEN1ALDH1A1
SCHEMBL14004520 0.88 MAPK8 (0.33) GLO1KMT2ARPS6KA3MEN1ALDH1A1
SCHEMBL14004571 0.87 CD40 (0.41) KMT2ARPS6KA3MAPTMEN1ALDH1A1

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 GLO1 266/4885KMT2A 801/4885RPS6KA3 3035/4885

“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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