SCHEMBL5897773

SCHEMBL5897773

Cc1ccc(NC(=O)CCC2CCCCC2)cc1NC(=O)c1ccc2nccnc2c1

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LDLR P01130 16/20 0.72
BRAF P15056 1/20 0.57
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
ALDH1A1 P00352 1/20 0.51
MAPK1 P28482 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
SCHEMBL5897731 0.89 LDLR (0.70) LDLRBRAFNPC1RAB9A
SCHEMBL6781226 0.86 LDLR (0.84) LDLRKMT2AMEN1NPC1RAB9A
SCHEMBL5897099 0.85 LDLR (0.81) LDLRBRAFKMT2AMEN1NPC1
SCHEMBL6783138 0.84 LDLR (0.86) LDLRKMT2AMEN1NPC1RAB9A
SCHEMBL6780802 0.84 LDLR (1.00) LDLRBRAFKMT2AMEN1NPC1
SCHEMBL6787743 0.83 LDLR (1.00) LDLRKMT2AMEN1NPC1RAB9A
SCHEMBL6782644 0.83 LDLR (1.00) LDLRKMT2AMEN1NPC1RAB9A
SCHEMBL6777396 0.83 LDLR (0.98) LDLRBRAFKMT2AMEN1NPC1
SCHEMBL5897132 0.83 LDLR (0.72) LDLRKMT2AMEN1NPC1RAB9A
SCHEMBL6786687 0.82 LDLR (0.81) LDLRKMT2AMEN1ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7060700-B2 Amide derivatives useful as inhibitors of the production of cytokines ASTRAZENECA AB (SE) 2006-06-13 US disclosed
US-20030105142-A1 Amide derivatives useful as inhibitors of the production of cytokines ASTRAZENECA AB 2003-06-05 US disclosed
US-6432949-B1 Amide derivatives useful as inhibitors of the production of cytokines ASTRAZENECA AB (SE) 2002-08-13 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-20030105142-A1 Amide derivatives useful as inhibitors of the production of cytokines IL6, IL6ST, IL2 LDLR 2806/4885BRAF 1764/4885KMT2A 3225/4885

“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.