SCHEMBL1330153

SCHEMBL1330153

CCc1cccc(CC)c1-c1cc(OC)c(COc2ccc(Oc3ccccc3)cc2)cn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 5/20 0.39
LTA4H P09960 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
FFAR1 O14842 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ATM Q13315 1/20 0.38
PTGER4 P35408 2/20 0.38
PARP15 Q460N3 1/20 0.37
PARP10 Q53GL7 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TSPO P30536 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
SCHEMBL1329080 0.95 C5AR1 (0.41) C5AR1MEN1KMT2AL3MBTL1MAPT
SCHEMBL1329002 0.94 KDM4E (0.40) C5AR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL1327580 0.89 L3MBTL1 (0.41) LTA4HFFAR1L3MBTL1TDP1
SCHEMBL1328369 0.87 PTGER4 (0.43) C5AR1KMT2AFFAR1PTGER4
SCHEMBL1327581 0.87 MAPT (0.41) C5AR1L3MBTL1MAPTHPGDATM
SCHEMBL1329711 0.86 PARP15 (0.44) C5AR1MEN1KMT2AKDM4EALDH1A1
SCHEMBL1329562 0.86 MEN1 (0.40) C5AR1MEN1KMT2AALDH1A1MAPT
SCHEMBL1328043 0.85 FFAR1 (0.42) C5AR1FFAR1
SCHEMBL1328720 0.85 MAPT (0.42) C5AR1MEN1KMT2AL3MBTL1MAPT
SCHEMBL1329593 0.84 FOXM1 (0.44) C5AR1FFAR1

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 C5AR1 2/4885LTA4H 487/4885MEN1 3563/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 C5AR1 2/4885LTA4H 487/4885MEN1 3563/4885

“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.