SCHEMBL2428396

SCHEMBL2428396

CCN(CCCOC(C)=O)c1cc(NC(C)=O)ccc1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 4/20 0.43
MAPT P10636 4/20 0.42
HTT P42858 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 2/20 0.41
HPGD P15428 1/20 0.41
RECQL P46063 1/20 0.41
RORC P51449 1/20 0.41
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FAAH O00519 1/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL16311853 0.91 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL7763596 0.87 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL30500761 0.85 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL1413103 0.85 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL11319818 0.85 MAPT (0.49) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL11520824 0.84 ALDH1A1 (0.48) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL2424467 0.84 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL11691999 0.83 ALDH1A1 (0.47) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL7769794 0.83 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1MAPTHTTMEN1
SCHEMBL11330953 0.81 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1MAPTHTTMEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1668079-B1 ADSORBABLE ORGANIC HALOGEN (AOX)-FREE NAVY AND BLACK DISPERSE DYES DYSTAR COLOURS DEUTSCHLAND (DE) 2011-09-14 EP disclosed
EP-1668079-A1 ADSORBABLE ORGANIC HALOGEN (AOX)-FREE NAVY AND BLACK DISPERSE DYES DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2006-06-14 EP disclosed
US-7060807-B2 AOX-free navy and black disperse dyes DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2006-06-13 US disclosed
WO-2005030877-A1 ADSORBABLE ORGANIC HALOGEN (AOX)-FREE NAVY AND BLACK DISPERSE DYES DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2005-04-07 WO disclosed
US-20050070648-A1 Monoazo dyes; coloring synthetic textiles DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2005-03-31 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-20050070648-A1 Monoazo dyes; coloring synthetic textiles IK, CYP1A1, PBRM1 SMN1; SMN2 1376/4885ALDH1A1 485/4885MAPT 794/4885

“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.