SCHEMBL6782017

SCHEMBL6782017

COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(N4CCOCC4)c3C)ccc2C)cc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.60
MAPT P10636 4/20 0.60
KMT2A Q03164 3/20 0.60
MEN1 O00255 2/20 0.60
PKM P14618 1/20 0.60
SMN1; SMN2 Q16637 3/20 0.59
TP53 P04637 1/20 0.59
THRB P10828 1/20 0.59
MAPK14 Q16539 6/20 0.57
NPC1 O15118 3/20 0.56
RAB9A P51151 3/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HTT P42858 1/20 0.51
SMO Q99835 1/20 0.51
USP2 O75604 1/20 0.49

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
SCHEMBL6780903 0.85 MAPT (0.71) ALDH1A1MAPTKMT2AMEN1PKM
SCHEMBL6477116 0.81 MAPK14 (0.66) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL6782012 0.80 MAPK14 (0.60) ALDH1A1MAPTKMT2AMEN1PKM
SCHEMBL6777439 0.79 BRPF1 (0.59) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL6475916 0.79 MAPK14 (0.66) ALDH1A1MAPTKMT2AMEN1PKM
SCHEMBL6974566 0.79 MAPK14 (0.58) MAPK14
SCHEMBL6780902 0.79 KMT2A (0.67) ALDH1A1MAPTKMT2AMEN1PKM
SCHEMBL6780689 0.78 MAPK14 (0.64) ALDH1A1MAPTKMT2AMEN1PKM
SCHEMBL6485299 0.78 MAPK14 (0.67) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL6477080 0.77 MAPK14 (0.66) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2

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 ALDH1A1 262/4885MAPT 3738/4885KMT2A 2245/4885

“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.