SCHEMBL13490369

SCHEMBL13490369

Cc1nc(C2CCNCC2)ccc1C(=O)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLAT P00750 6/20 0.42
GPR119 Q8TDV5 1/20 0.38
SLC6A4 P31645 2/20 0.37
PDE10A Q9Y233 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
USP2 O75604 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 1/20 0.35
CLK4 Q9HAZ1 1/20 0.35
SLC6A2 P23975 1/20 0.35
HTR2C P28335 2/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
USP7 Q93009 1/20 0.35
PARP1 P09874 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL18838576 0.75 GPR119 (0.39) PLATGPR119SLC6A4CYP1A2CLK4
SCHEMBL10080114 0.74 HTR2C (0.46) TLR9TLR8TLR7HTR2CGABRA1
Hydrochloric Acid SCHEMBL18838569 0.74 GPR119 (0.38) PLATGPR119SLC6A4HSD17B10
SCHEMBL31701047 0.73 CYP1A2 (0.47) PLATPDE10AUSP2CYP1A2CYP2C9
SCHEMBL21816284 0.72 GABRP (0.53) CYP1A2GABRA1GABRB2ALDH1A1
SCHEMBL18921631 0.72 GPR119 (0.37) PLATGPR119USP2CLK4TSHR
SCHEMBL28014566 0.71 NNMT (0.51) GABRA1GABRB2PARP1ALDH1A1
SCHEMBL7672752 0.71 HTR2C (0.51) SLC6A4SLC6A2HTR2C
SCHEMBL38665048 0.70 GABRP (0.40) GPR119HTR2CGABRA1GABRB2PARP1
SCHEMBL20060979 0.70 GPR119 (0.52) PLATGPR119SLC6A4USP2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8530662-B2 Pyridyltetrahydropyridines and pyridylpiperidines, and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2013-09-10 US disclosed
US-8530662-B2 Pyridyltetrahydropyridines and pyridylpiperidines, and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2013-09-10 US disclosed
US-20100029947-A1 Pyridyltetrahydropyridines and Pyridylpiperidines, and Method of Manufacturing Them FUJIFILM FINECHEMICALS CO., LTD 2010-02-04 US disclosed
US-7632950-B2 Pyridyltetrahydropyridines and pyridylpiperidines and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2009-12-15 US disclosed
US-20070093528-A1 Pyridyltetrahydropyridines and pyridylpiperidines and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2007-04-26 US disclosed
US-20070093528-A1 Pyridyltetrahydropyridines and pyridylpiperidines and method of manufacturing them FUJIFILM FINECHEMICALS CO., LTD (JP) 2007-04-26 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-20100029947-A1 Pyridyltetrahydropyridines and Pyridylpiperidines, and Method of Manufacturing Them QDPR, HRH4, HRH2 PLAT 1652/4885GPR119 1549/4885SLC6A4 2592/4885
US-20070093528-A1 Pyridyltetrahydropyridines and pyridylpiperidines and method of manufacturing them QDPR, HRH4, HRH2 PLAT 1634/4885GPR119 1240/4885SLC6A4 2362/4885

“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.