SCHEMBL1327973

SCHEMBL1327973

CCc1cccc(CC)c1-c1cc(OC)c(COc2cc(C)ccc2OC)cn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
C5AR1 P21730 7/20 0.41
ACHE P22303 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.38
TSHR P16473 2/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
MAPT P10636 2/20 0.38
TP53 P04637 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL1328930 0.95 L3MBTL1 (0.53) KDM4EL3MBTL1C5AR1ACHESMN1; SMN2
SCHEMBL1328225 0.92 L3MBTL1 (0.44) KDM4EL3MBTL1C5AR1SMN1; SMN2MAPT
SCHEMBL1329038 0.92 L3MBTL1 (0.43) KDM4EL3MBTL1C5AR1SMN1; SMN2TSHR
SCHEMBL1328620 0.92 C5AR1 (0.44) KDM4EL3MBTL1C5AR1SMN1; SMN2SLC6A2
SCHEMBL1328504 0.90 KDM4E (0.42) KDM4EL3MBTL1C5AR1SMN1; SMN2TSHR
SCHEMBL1327309 0.88 LPAR1 (0.41) KDM4EL3MBTL1C5AR1SMN1; SMN2TSHR
SCHEMBL1328479 0.86 L3MBTL1 (0.40) KDM4EL3MBTL1C5AR1SMN1; SMN2TSHR
SCHEMBL1329473 0.84 RECQL (0.43) KDM4EL3MBTL1C5AR1TSHRMAPK1
SCHEMBL1328871 0.84 C5AR1 (0.38) KDM4EL3MBTL1C5AR1
SCHEMBL1328970 0.84 C5AR1 (0.38) KDM4EL3MBTL1C5AR1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 2088/4885L3MBTL1 3202/4885C5AR1 2/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 KDM4E 2088/4885L3MBTL1 3202/4885C5AR1 2/4885

“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.