SCHEMBL1328151

SCHEMBL1328151

CCc1cccc(CC)c1-c1ccc(CN2CCCCC2Cc2ccccc2)c(C)n1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.39
HSD17B10 Q99714 2/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
DAGLB Q8NCG7 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PDCD1LG2 Q9BQ51 2/20 0.36
CD274 Q9NZQ7 2/20 0.36
CRHR1 P34998 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
SCHEMBL1330164 0.85 CRHR1 (0.38) OPRD1HSD17B10LMNATP53ALDH1A1
SCHEMBL1327969 0.80 C5AR1 (0.41) HSD17B10LMNATP53ALDH1A1DAGLB
SCHEMBL1327493 0.76 MEN1 (0.46) OPRD1HSD17B10ALDH1A1NPSR1MEN1
SCHEMBL1327679 0.75 CD274 (0.41) ALDH1A1DAGLBMEN1KMT2ACD274
SCHEMBL1328034 0.74 MEN1 (0.40) OPRD1HSD17B10LMNATP53ALDH1A1
SCHEMBL2142204 0.72 ALDH1A1 (0.38) HSD17B10ALDH1A1NPSR1MEN1KMT2A
SCHEMBL1327959 0.72 DRD2 (0.45) ALDH1A1PDCD1LG2CD274
SCHEMBL27492 0.72
SCHEMBL2139807 0.72 HSD17B10 (0.38) HSD17B10ALDH1A1NPSR1MEN1KMT2A
SCHEMBL1327727 0.71 C5AR1 (0.42) HSD17B10ALDH1A1NPSR1MEN1KMT2A

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 OPRD1 506/4885HSD17B10 4436/4885LMNA 3672/4885
US-20090176980-A1 3-Substituted-6-Aryl Pyridines C3AR1, C5AR1, C5AR2 OPRD1 506/4885HSD17B10 4436/4885LMNA 3672/4885

“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.