SCHEMBL3079443

SCHEMBL3079443

CC(C)(C)OC(=O)N1CCC(c2ccc(OCCCOc3cccc(F)c3F)cc2)C(O)C1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.45
PDE4B Q07343 1/20 0.44
BTK Q06187 2/20 0.41
ENPP2 Q13822 1/20 0.40
LIPE Q05469 1/20 0.40
TACR1 P25103 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
SCHEMBL3073170 0.93 PDE4B (0.47) GPR119PDE4BBTKENPP2LIPE
SCHEMBL3078429 0.90 GPR119 (0.47) GPR119PDE4BBTKENPP2TACR1
SCHEMBL3071388 0.89 GPR119 (0.49) GPR119PDE4BENPP2LIPETACR1
SCHEMBL3072978 0.88 GPR119 (0.47) GPR119PDE4BENPP2LIPE
SCHEMBL3072614 0.88 GPR119 (0.47) GPR119PDE4BENPP2LIPETACR1
SCHEMBL3084252 0.87 ALDH1A1 (0.39)
SCHEMBL3073950 0.86 PDE4B (0.56) GPR119PDE4BTACR1
SCHEMBL3080028 0.86 PDE4B (0.48) GPR119PDE4BLIPETACR1
SCHEMBL3059539 0.86 PDE4B (0.52) GPR119PDE4BTACR1
SCHEMBL3067284 0.86 GPR119 (0.48) GPR119PDE4BENPP2TACR1

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 GPR119 729/4885PDE4B 312/4885BTK 2403/4885
US-20070010511-A1 Organic compounds REN, ACE, ACE2 GPR119 729/4885PDE4B 312/4885BTK 2403/4885

“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.