SCHEMBL1327366

SCHEMBL1327366

CCc1cccc(CC)c1-c1cc(OC(C)C)c(CN2CCCC3CCCCC32)c(C)n1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 18/20 0.42
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL2142255 0.85 C5AR1 (0.41) C5AR1
SCHEMBL1328344 0.84 C5AR1 (0.41) C5AR1GAA
SCHEMBL1328062 0.83 KDM4E (0.52) C5AR1POLBKDM4E
SCHEMBL1327628 0.83 C5AR1 (0.39) C5AR1POLBGAA
SCHEMBL1327969 0.83 C5AR1 (0.41) C5AR1
SCHEMBL1328948 0.82 C5AR1 (0.42) C5AR1POLBGAAKDM4E
SCHEMBL1327727 0.82 C5AR1 (0.42) C5AR1
SCHEMBL1330436 0.81 KDM4E (0.43) C5AR1POLBGAAKDM4E
SCHEMBL2139080 0.81 MEN1 (0.43) C5AR1POLBGAAKDM4E
SCHEMBL2140205 0.81 MEN1 (0.43) C5AR1POLBGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES HUTCHINSON ALAN J (US) 2011-11-17 US disclosed
US-7863454-B2 3-substituted-6-aryl pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-01-04 US disclosed
US-20090176980-A1 3-Substituted-6-Aryl Pyridines NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2009-07-09 US disclosed
US-7342115-B2 Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology NEUROGEN CORPORATION (US) 2008-03-11 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 (2 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-20110281837-A1 3-SUBSTITUTED-6-ARYL PYRIDINES C3AR1, C5AR1, C5AR2 C5AR1 2/4885POLB 4733/4885GAA 4839/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 C5AR1 2/4885POLB 4733/4885GAA 4839/4885

“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.