SCHEMBL3070523

SCHEMBL3070523

CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCOc3ccccc3Cl)cc2)C(O)C1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.47
GPR119 Q8TDV5 9/20 0.45
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
PPARA Q07869 1/20 0.44
STS P08842 2/20 0.42
TACR1 P25103 1/20 0.41
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TACR3 P29371 1/20 0.40

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
SCHEMBL3073950 0.90 PDE4B (0.56) PDE4BGPR119TACR1
SCHEMBL3080028 0.90 PDE4B (0.48) PDE4BGPR119TACR1TDP1L3MBTL1
SCHEMBL3059539 0.90 PDE4B (0.52) PDE4BGPR119STSTACR1
SCHEMBL3073170 0.89 PDE4B (0.47) PDE4BGPR119TACR1
SCHEMBL3065750 0.88 PDE4B (0.54) PDE4BGPR119TACR1
SCHEMBL3059506 0.87 PDE4B (0.44) PDE4BGPR119PPARGPPARDPPARA
SCHEMBL3071388 0.87 GPR119 (0.49) PDE4BGPR119TACR1TACR3
SCHEMBL3077026 0.87 PPARG (0.44) PPARGPPARDPPARAMAPTTDP1
SCHEMBL6957828 0.86 PPARG (0.43) PDE4BPPARGPPARDPPARAMAPT
SCHEMBL3079443 0.86 GPR119 (0.45) PDE4BGPR119TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7842688-B2 Organic compounds NOVARTIS PHARMA AG (CH) 2010-11-30 US disclosed
US-7790715-B2 Organic compounds NOVARTIS AG (CH) 2010-09-07 US disclosed
US-20090012055-A1 Organic compounds HEROLD PETER 2009-01-08 US disclosed
EP-1961752-A2 Piperidine Compounds Speedel Experimenta AG (CH) 2008-08-27 EP disclosed
US-20070010511-A1 Organic compounds NOVARTIS PHARMA AG (CH) 2007-01-11 US disclosed
EP-1670760-A1 ORGANIC COMPOUNDS Speedel Experimenta AG (CH) 2006-06-21 EP disclosed
WO-2005061457-A1 ORGANIC COMPOUNDS SPEEDEL EXPERIMENTA AG (CH) 2005-07-07 WO 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-20090012055-A1 Organic compounds REN, ACE, ACE2 PDE4B 312/4885GPR119 729/4885PPARG 258/4885
US-20070010511-A1 Organic compounds REN, ACE, ACE2 PDE4B 312/4885GPR119 729/4885PPARG 258/4885

“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.