SCHEMBL339519

SCHEMBL339519

CCC(N)c1cc2nccn2cc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.37
EGLN2 Q96KS0 1/20 0.37
NPC1 O15118 1/20 0.37
DPP8 Q6V1X1 2/20 0.36
TGFBR1 P36897 1/20 0.35
RORC P51449 1/20 0.35
CRHR1 P34998 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
SCHEMBL339079 0.87 LMNA (0.44) DPP4EGLN2NPC1DPP8TGFBR1
SCHEMBL1913156 0.79 EGLN2 (0.41) DPP4EGLN2NPC1DPP8TGFBR1
SCHEMBL339578 0.77 DPP4 (0.43) DPP4EGLN2NPC1DPP8TGFBR1
SCHEMBL339621 0.74 EGLN2 (0.41) DPP4EGLN2NPC1TGFBR1RORC
SCHEMBL340171 0.73 NPC1 (0.33) EGLN2NPC1TGFBR1RORC
SCHEMBL1913172 0.72 NPC1 (0.41) DPP4EGLN2NPC1RORC
SCHEMBL339104 0.72 KDM4E (0.45) EGLN2NPC1
SCHEMBL1911471 0.72 EGLN2 (0.41) DPP4EGLN2NPC1TGFBR1
SCHEMBL338509 0.72 TDP1 (0.41) DPP4EGLN2NPC1DPP8TGFBR1
SCHEMBL4724441 0.71 ALDH1A1 (0.43) EGLN2NPC1

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 9 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

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 DPP4 120/4885EGLN2 1199/4885NPC1 605/4885
US-20090253689-A1 Organic Compounds OAT, GPR119, OTC DPP4 120/4885EGLN2 1199/4885NPC1 605/4885

“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.