SCHEMBL6776926

SCHEMBL6776926

COc1ccc(C(=O)Nc2cc(NC(=O)CCC3CCCCC3)ccc2C)cc1

nearest known ligand 0.82

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LDLR P01130 11/20 0.82
NPSR1 Q6W5P4 1/20 0.57
KLK7 P49862 1/20 0.54
ALDH1A1 P00352 3/20 0.54
LMNA P02545 2/20 0.54
EPHX2 P34913 1/20 0.53
MAPK14 Q16539 1/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL6786687 0.91 LDLR (0.81) LDLRNPSR1ALDH1A1LMNAKMT2A
SCHEMBL6786269 0.90 LDLR (1.00) LDLRNPSR1ALDH1A1LMNAKMT2A
SCHEMBL6786897 0.89 LDLR (0.98) LDLRNPSR1ALDH1A1LMNAKMT2A
SCHEMBL6781226 0.89 LDLR (0.84) LDLRNPSR1ALDH1A1LMNAKMT2A
SCHEMBL6783138 0.89 LDLR (0.86) LDLRNPSR1ALDH1A1LMNAKMT2A
SCHEMBL6780802 0.89 LDLR (1.00) LDLRNPSR1ALDH1A1MAPK14KMT2A
SCHEMBL6782262 0.88 LDLR (0.74) LDLRNPSR1ALDH1A1LMNAMAPK14
SCHEMBL6787743 0.88 LDLR (1.00) LDLRNPSR1ALDH1A1LMNAKMT2A
SCHEMBL6777396 0.88 LDLR (0.98) LDLRNPSR1ALDH1A1LMNAMAPK14
SCHEMBL6782644 0.88 LDLR (1.00) LDLRNPSR1ALDH1A1LMNAMAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6686467-B2 INHIBITORS OF THE PRODUCTION OF CYTOKINES SUCH AS TUMOUR NECROSIS FACTOR (HEREINAFTER TNF), FOR EXAMPLE TNF ALPHA , AND VARIOUS MEMBERS OF THE INTERLEUKIN (HEREINAFTER IL) FAMILY, FOR EXAMPLE IL-1, IL-6 AND IL-8 ZENECA LIMITED (GB) 2004-02-03 US disclosed
US-20030166730-A1 Amide derivatives for the treatment of diseases mediated by cytokines ZENECA LIMITED 2003-09-04 US disclosed
US-6498274-B1 Amide derivatives for the treatment of diseases mediated by cytokines ZENECA LIMITED (GB) 2002-12-24 US disclosed
EP-1017378-B1 AMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ASTRAZENECA AB (SE) 2002-12-11 EP disclosed
EP-1017378-A1 AMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca UK Limited (GB) 2000-07-12 EP disclosed
WO-1999015164-A1 AMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ZENECA LIMITED (GB) 1999-04-01 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-20030166730-A1 Amide derivatives for the treatment of diseases mediated by cytokines IL2, IL6, IL6ST LDLR 2621/4885NPSR1 951/4885KLK7 4297/4885

“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.