SCHEMBL14004359

SCHEMBL14004359

C=CS(=O)(=O)CCNc1nc(NCCCOC)c(C#N)c(C)c1/N=N/c1ccc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CTRB1 P17538 1/20 0.35
▸ KDM4E B2RXH2 8/20 0.34
▸ KMT2A Q03164 6/20 0.34
▸ MEN1 O00255 5/20 0.34
▸ TDP1 Q9NUW8 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ CYP1A2 P05177 2/20 0.33
▸ POLB P06746 3/20 0.33
▸ ALDH1A1 P00352 5/20 0.32
▸ MAPK8 P45983 1/20 0.31
▸ MAPK9 P45984 1/20 0.31
▸ MAPK10 P53779 1/20 0.31
▸ GAA P10253 2/20 0.31
▸ HPGD P15428 1/20 0.31
▸ MAPK1 P28482 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ ATM Q13315 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
SCHEMBL14004374 1.00 CTRB1 (0.35) CTRB1KDM4EKMT2AMEN1TDP1
SCHEMBL14030074 0.92 CTRB1 (0.36) CTRB1KDM4EKMT2AMEN1TDP1
SCHEMBL14029561 0.92 CTRB1 (0.36) CTRB1KDM4EKMT2AMEN1TDP1
SCHEMBL14004526 0.91 KDM4E (0.34) KDM4EKMT2AMEN1TDP1THRB
SCHEMBL14004528 0.91 KDM4E (0.34) KDM4EKMT2AMEN1TDP1THRB
SCHEMBL14004357 0.90 MPL (0.35) KDM4EKMT2AMEN1TDP1MAPT
SCHEMBL14004362 0.86 CYP1A2 (0.39) KDM4EKMT2AMEN1TDP1THRB
SCHEMBL14004354 0.86 CYP1A2 (0.39) KDM4EKMT2AMEN1TDP1THRB
SCHEMBL14004527 0.86 MAPK8 (0.33) KDM4EKMT2AMEN1POLBALDH1A1
SCHEMBL14004520 0.86 MAPK8 (0.33) KDM4EKMT2AMEN1POLBALDH1A1

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 CTRB1 2117/4885KDM4E 390/4885KMT2A 801/4885

“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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