SCHEMBL339079

SCHEMBL339079

CC(N)c1cc2nccn2cc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
TP53 P04637 1/20 0.44
HTT P42858 1/20 0.44
EGLN2 Q96KS0 1/20 0.39
NPC1 O15118 1/20 0.39
DPP4 P27487 2/20 0.37
HSD11B1 P28845 1/20 0.35
JAK2 O60674 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
TGFBR1 P36897 1/20 0.35
DPP8 Q6V1X1 1/20 0.34
RORC P51449 1/20 0.34
MAPK14 Q16539 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
SCHEMBL339519 0.87 DPP4 (0.37) EGLN2NPC1DPP4TGFBR1DPP8
SCHEMBL340171 0.78 NPC1 (0.33) EGLN2NPC1JAK2HTR2AHTR2C
SCHEMBL1913156 0.77 EGLN2 (0.41) EGLN2NPC1DPP4HSD11B1TGFBR1
SCHEMBL339578 0.77 DPP4 (0.43) LMNAEGLN2NPC1DPP4TGFBR1
SCHEMBL1913172 0.75 NPC1 (0.41) EGLN2NPC1DPP4HSD11B1RORC
SCHEMBL339104 0.74 KDM4E (0.45) EGLN2NPC1
SCHEMBL1911471 0.74 EGLN2 (0.41) LMNAHTTEGLN2NPC1DPP4
SCHEMBL339621 0.74 EGLN2 (0.41) EGLN2NPC1DPP4HSD11B1TGFBR1
SCHEMBL338509 0.74 TDP1 (0.41) LMNAEGLN2NPC1DPP4HSD11B1
SCHEMBL4724441 0.73 ALDH1A1 (0.43) TP53EGLN2NPC1

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 12 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
EP-2004643-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2008-12-24 EP disclosed
WO-2007113226-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2007-10-11 WO 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 3629/4885TP53 3540/4885HTT 3260/4885
US-20090253689-A1 Organic Compounds OAT, GPR119, OTC LMNA 3629/4885TP53 3540/4885HTT 3260/4885

“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.