SCHEMBL340191

SCHEMBL340191

NCc1cc2nnc(N)n2cc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
DPP4 P27487 15/20 0.41
DPP8 Q6V1X1 7/20 0.38
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MGAM O43451 1/20 0.38
ALDH1A1 P00352 1/20 0.38
SI P14410 1/20 0.38
RAB9A P51151 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
HTT P42858 1/20 0.37
HSD11B1 P28845 1/20 0.37
DPP9 Q86TI2 2/20 0.36
CYP3A4 P08684 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
SCHEMBL1913160 0.88 LMNA (0.41) LMNADPP4DPP8GAAKDM4E
SCHEMBL338576 0.81 DPP4 (0.40) LMNADPP4DPP8DPP9CYP3A4
SCHEMBL339838 0.78 DPP4 (0.42) LMNADPP4DPP8GAAKDM4E
SCHEMBL340289 0.76 DPP4 (0.41) LMNADPP4DPP8HSD11B1DPP9
SCHEMBL339441 0.76 IDO1 (0.41) GAAKDM4EALDH1A1HTT
SCHEMBL338950 0.74 ALDH1A1 (0.40) LMNADPP4DPP8KDM4EALDH1A1
SCHEMBL339713 0.74 DPP4 (0.40) DPP4DPP8DPP9CYP3A4
SCHEMBL339578 0.74 DPP4 (0.43) LMNADPP4DPP8DPP9CYP3A4
SCHEMBL868834 0.73 DPP4 (0.39) DPP4DPP8RAB9ADPP9CYP3A4
SCHEMBL339714 0.73 DPP4 (0.45) DPP4DPP8ALDH1A1RAB9AHSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120077787-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-03-29 US disclosed
US-20120077787-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-03-29 US disclosed
US-20120077787-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-03-29 US disclosed
US-8097617-B2 Organic compounds NOVARTIS AG (CH) 2012-01-17 US disclosed
US-8097617-B2 Organic compounds NOVARTIS AG (CH) 2012-01-17 US disclosed
US-8097617-B2 Organic compounds NOVARTIS AG (CH) 2012-01-17 US disclosed
US-20090253689-A1 Organic Compounds NOVARTIS AG (CH) 2009-10-08 US disclosed
US-20090253689-A1 Organic Compounds NOVARTIS AG (CH) 2009-10-08 US disclosed
US-20090253689-A1 Organic Compounds NOVARTIS AG (CH) 2009-10-08 US disclosed
WO-2007113226-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-10-11 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-20120077787-A1 ORGANIC COMPOUNDS OAT, GPR119, OTC LMNA 3629/4885DPP4 120/4885DPP8 403/4885
US-20090253689-A1 Organic Compounds OAT, GPR119, OTC LMNA 3629/4885DPP4 120/4885DPP8 403/4885

“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.