SCHEMBL6782644

SCHEMBL6782644

Cc1ccc(NC(=O)CCC2CCCCC2)cc1NC(=O)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LDLR P01130 14/20 1.00
▸ ALDH1A1 P00352 3/20 0.60
▸ MEN1 O00255 3/20 0.60
▸ KMT2A Q03164 3/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ MAPT P10636 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.53
▸ NPC1 O15118 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ NFKB1 P19838 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ NFKB2 Q00653 1/20 0.51
▸ RELA Q04206 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ MAPK14 Q16539 1/20 0.51

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
SCHEMBL6783138 0.93 LDLR (0.86) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6781265 0.92 LDLR (0.85) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6781226 0.90 LDLR (0.84) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6780802 0.90 LDLR (1.00) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6781832 0.90 LDLR (1.00) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5897099 0.89 LDLR (0.81) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6787743 0.89 LDLR (1.00) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6777396 0.89 LDLR (0.98) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6778422 0.89 LDLR (1.00) LDLRALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL6786687 0.89 LDLR (0.81) LDLRALDH1A1MEN1KMT2ASMN1; 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 16 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030166730-A1 Amide derivatives for the treatment of diseases mediated by cytokines ZENECA LIMITED 2003-09-04 — — US claimed
JP-2001517620-A — — 2001-10-09 — — JP claimed
EP-1017378-A1 AMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES AstraZeneca UK Limited (GB) 2000-07-12 — — EP claimed
EP-0941084-A1 RAF KINASE INHIBITORS ZENECA LIMITED (GB) 1999-09-15 — — EP claimed
WO-1999015164-A1 AMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ZENECA LIMITED (GB) 1999-04-01 — — WO claimed
WO-1998022103-A1 RAF KINASE INHIBITORS ZENECA LIMITED (GB) 1998-05-28 — — WO claimed
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
EP-0941084-A1 RAF KINASE INHIBITORS ZENECA LIMITED (GB) 1999-09-15 — — EP disclosed
EP-0941084-A1 RAF KINASE INHIBITORS ZENECA LIMITED (GB) 1999-09-15 — — EP disclosed
WO-1999015164-A1 AMIDE DERIVATIVES FOR THE TREATMENT OF DISEASES MEDIATED BY CYTOKINES ZENECA LIMITED (GB) 1999-04-01 — — WO disclosed
WO-1998022103-A1 RAF KINASE INHIBITORS ZENECA LIMITED (GB) 1998-05-28 — — WO disclosed
WO-1998022103-A1 RAF KINASE INHIBITORS ZENECA LIMITED (GB) 1998-05-28 — — 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 2621/4885ALDH1A1 262/4885MEN1 1738/4885

“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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