SCHEMBL1327637

SCHEMBL1327637

CCc1cc(OCc2c(C)cc(-c3c(CC)cccc3CC)nc2C)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 2/20 0.39
HPGD P15428 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
KDM4E B2RXH2 3/20 0.38
MCL1 Q07820 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
C5AR1 P21730 4/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
P4HB P07237 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
GAA P10253 1/20 0.35
TSHR P16473 1/20 0.35
NPY1R P25929 1/20 0.35

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
SCHEMBL1328403 0.93 MRGPRX4 (0.44) L3MBTL1LMNAHPGDALDH1A1MAPT
SCHEMBL1329779 0.90 PPARG (0.38) LMNAHPGDSMN1; SMN2KDM4EC5AR1
SCHEMBL1329327 0.89 C5AR1 (0.45) L3MBTL1LMNAHPGDALDH1A1MAPT
SCHEMBL2141583 0.87 PTGDR2 (0.39) MAPTGPR84NR1H4
SCHEMBL1329437 0.87 C5AR1 (0.39) L3MBTL1ALDH1A1MAPTPOLBKDM4E
SCHEMBL1329519 0.86 C5AR1 (0.38) L3MBTL1LMNAHPGDALDH1A1MAPT
SCHEMBL1328305 0.86 MRGPRX4 (0.42) L3MBTL1LMNAHPGDMAPTPOLB
SCHEMBL1329374 0.86 ALOX5 (0.40) LMNAHPGDALDH1A1MAPTSMN1; SMN2
SCHEMBL1327287 0.85 BRD4 (0.39) L3MBTL1LMNAHPGDALDH1A1MAPT
SCHEMBL1328708 0.84 C5AR1 (0.40) L3MBTL1LMNAHPGDMAPTSMN1; SMN2

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 L3MBTL1 3202/4885LMNA 3672/4885HPGD 2471/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 L3MBTL1 3202/4885LMNA 3672/4885HPGD 2471/4885

“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.