SCHEMBL6782607

SCHEMBL6782607

CC(=O)Oc1ccc(C(=O)Nc2cc(NC(=O)CCc3ccccc3)ccc2C)cc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LDLR P01130 3/20 0.66
HDAC1 Q13547 2/20 0.58
KMT2A Q03164 4/20 0.53
MEN1 O00255 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
GAA P10253 1/20 0.52
HDAC3 O15379 1/20 0.52
HDAC2 Q92769 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
NPSR1 Q6W5P4 3/20 0.50
MAPT P10636 2/20 0.50
LMNA P02545 2/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
TSHR P16473 1/20 0.50
KDM4E B2RXH2 1/20 0.48
CYP2C9 P11712 1/20 0.48

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
SCHEMBL6780243 0.86 LDLR (0.62) LDLRHDAC1KMT2AMEN1SMN1; SMN2
SCHEMBL6786897 0.80 LDLR (0.98) LDLRKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL6786269 0.79 LDLR (1.00) LDLRKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL6783005 0.78 LDLR (0.89) LDLRKMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL6782591 0.77 LDLR (0.82) LDLRKMT2AMEN1RAB9ANPC1
SCHEMBL6485956 0.75 LDLR (0.57) LDLRKMT2AMEN1RAB9ANPC1
SCHEMBL6866814 0.75 KMT2A (0.82) HDAC1KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5488236 0.74 HDAC1 (1.00) HDAC1KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL2606723 0.74 CYP2C9 (0.56) HDAC1KMT2AMEN1SMN1; SMN2RAB9A
Dimethylamine SCHEMBL8531062 0.73 POLB (0.61) LDLRHDAC1KMT2AMEN1NPC1

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 2621/4885HDAC1 390/4885KMT2A 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.