SCHEMBL5352795

SCHEMBL5352795

CCOc1ccc(N)c(NCCO)c1NCCO.COc1cc(OC)c(NCCO)cc1NCCO

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
PDE4A P27815 3/20 0.40
PDE4B Q07343 3/20 0.40
PDE4C Q08493 3/20 0.40
PDE4D Q08499 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
GAA P10253 2/20 0.40
MAPK1 P28482 2/20 0.36
HSD17B10 Q99714 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 1/20 0.36
TNF P01375 1/20 0.36
NPC1 O15118 1/20 0.35
USP2 O75604 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 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
SCHEMBL1383429 0.87 POLB (0.42) POLBPDE4APDE4BPDE4CPDE4D
SCHEMBL454595 0.77 TNF (0.44) POLBKDM4EMAPTGAAMAPK1
SCHEMBL5831954 0.76 TDP1 (0.35) POLBKDM4EMAPTGAAMAPK1
SCHEMBL11142464 0.74 MAPT (0.49) POLBKDM4EMAPTGAAMAPK1
Hydrochloric Acid SCHEMBL11140483 0.73 GAA (0.51) POLBKDM4EMAPTGAAMAPK1
SCHEMBL8031008 0.73 TSHR (0.39) POLBKDM4EMAPTGAAMAPK1
SCHEMBL28088166 0.72 TNF (0.40) POLBKDM4EL3MBTL1MEN1ALDH1A1
Hydrochloric Acid SCHEMBL9793148 0.72 TSHR (0.38) POLBKDM4EMAPTGAAMAPK1
SCHEMBL3855076 0.71 RAD52 (0.47) POLBKDM4EMAPTGAAMAPK1
Hydrochloric Acid SCHEMBL11143842 0.70 KDM4E (0.46) POLBKDM4EMAPTGAAMAPK1

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1468049-B1 YELLOW CATIONIC DYES FOR DYING OF ORGANIC MATERIAL BASF SE (DE) 2013-08-14 EP disclosed
US-7258702-B2 Yellow cationic dyes for dyeing of organic material CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-08-21 US disclosed
EP-1483334-B1 PROCESS FOR EXCHANGING THE ANIONS OF CATIONIC DYES CIBA SC HOLDING AG (CH) 2007-07-04 EP disclosed
US-7232467-B2 Dyeing hair with capped diazonium compound; intense, striking coloration; light, shampoo and rub fastness; storage stability; nondamaging, nonstaining CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-06-19 US disclosed
US-7229479-B2 Method of coloring porous material CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-06-12 US disclosed
US-7223295-B2 Dyeing hair with capped diazonium compound; intense, striking coloration; light, shampoo and rub fastness; storage stability; nondamaging, nonstaining CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-05-29 US disclosed
US-7192453-B2 Method of coloring keratin-containing fibres using diazonium salts CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-03-20 US disclosed
US-7166710-B2 Cationic dimeric dyes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-23 US disclosed
US-7166711-B2 Cationic dyes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-01-23 US disclosed
US-7091358-B2 Cationic substituted hydrazone dyes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2006-08-15 US disclosed
US-20040158937-A1 Cationic substituted hydrazone dyes CIBA SPECIALTY CHEMICALS CORP. 2004-08-19 US disclosed
EP-1438006-A1 METHOD OF COLOURING KERATIN-CONTAINING FIBRES USING DIAZONIUM SALTS Ciba SC Holding AG (CH) 2004-07-21 EP disclosed
EP-1430102-A1 CATIONIC REACTIVE DYES Ciba SC Holding AG (CH) 2004-06-23 EP disclosed
WO-2004019897-A1 METHOD OF COLOURING POROUS MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-03-11 WO disclosed
WO-2004019896-A1 METHOD OF COLOURING POROUS MATERIAL CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-03-11 WO disclosed
WO-2003076518-A2 PROCESS FOR EXCHANGING THE ANIONS OF CATIONIC COMPOUNDS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-09-18 WO disclosed
WO-2003070207-A1 METHOD OF COLOURING KERATIN-CONTAINING FIBRES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-08-28 WO disclosed
WO-2003060015-A1 YELLOW CATIONIC DYES FOR DYING OF ORGANIC MATERIAL CIBA SPECIALITY CHEMICALS HOLDING INC. (CH) 2003-07-24 WO disclosed
WO-2003032939-A1 METHOD OF COLOURING KERATIN-CONTAINING FIBRES USING DIAZONIUM SALTS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-04-24 WO disclosed
WO-2003029359-A1 CATIONIC REACTIVE DYES CIBA SPECIALTY CHEMICALS HOLDINGS INC. (CH) 2003-04-10 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-20040158937-A1 Cationic substituted hydrazone dyes KRT18, CYC1, COL1A1 POLB 2306/4885PDE4A 3914/4885PDE4B 4308/4885

“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.