SCHEMBL1327997

SCHEMBL1327997

CCc1cccc(CC)c1-c1cc(Oc2ccc3c(=O)[nH]c(=O)oc3c2)c(CN2CCCC(C)(C)C2)c(C)n1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
POLB P06746 1/20 0.33
MAOB P27338 1/20 0.32
GAA P10253 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1329394 0.84 KDM4E (0.36) KDM4EMAPTRAB9APOLBGAA
SCHEMBL2138907 0.82 KMT2A (0.34) KDM4EMAPTPOLBGAAALDH1A1
SCHEMBL1330420 0.81 RECQL (0.37) KDM4EMAPTRAB9APOLBGAA
SCHEMBL1329425 0.79 KDM4E (0.36) KDM4EMAPTRAB9A
SCHEMBL2143361 0.79 MAPT (0.36) KDM4EMAPTRAB9AGAAALDH1A1
SCHEMBL1327250 0.76 C5AR1 (0.38) KDM4EMAPTRAB9APOLBGAA
SCHEMBL2140494 0.76 ADORA2A (0.38)
SCHEMBL1328621 0.76 KDM4E (0.32) KDM4EMAPTRAB9A
SCHEMBL1328700 0.75 C5AR1 (0.39) KDM4EMAPTRAB9A
SCHEMBL2138917 0.73 ALDH1A1 (0.32) KDM4EMAPTRAB9APOLBGAA

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 KDM4E 2088/4885MAPT 4726/4885RAB9A 736/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 KDM4E 2088/4885MAPT 4726/4885RAB9A 736/4885

“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.