SCHEMBL339141

SCHEMBL339141

NCc1cc2ncc(-c3ccc(F)cc3)n2cc1-c1ccc(Cl)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 6/20 0.43
FLT3 P36888 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
PRMT5 O14744 3/20 0.38
WDR77 Q9BQA1 3/20 0.38
FYN P06241 1/20 0.37
RIPK2 O43353 1/20 0.36
DPP8 Q6V1X1 2/20 0.36
DPP9 Q86TI2 1/20 0.36
GRM5 P41594 1/20 0.36

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
SCHEMBL339336 0.90 DPP4 (0.43) DPP4PRMT5WDR77FYNRIPK2
SCHEMBL339714 0.89 DPP4 (0.45) DPP4FLT3SMN1; SMN2NPC1TP53
SCHEMBL338630 0.89 DPP4 (0.45) DPP4PRMT5WDR77FYNRIPK2
SCHEMBL339884 0.88 CYP3A4 (0.40) DPP4PRMT5WDR77FYNDPP8
SCHEMBL339203 0.83 KDR (0.44) DPP4FYNDPP8DPP9
SCHEMBL339824 0.83 RIPK2 (0.44) DPP4SMN1; SMN2KDM4ERAB9APRMT5
SCHEMBL869021 0.82 DPP4 (0.45) DPP4FLT3PRMT5WDR77FYN
SCHEMBL338487 0.82 DPP4 (0.46) DPP4PRMT5WDR77RIPK2DPP8
SCHEMBL338576 0.80 DPP4 (0.40) DPP4DPP8DPP9
SCHEMBL339319 0.79 DPP4 (0.48) DPP4NPC1RAB9AFYNRIPK2

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 120/4885FLT3 3747/4885SMN1; SMN2 1926/4885
US-20090253689-A1 Organic Compounds OAT, GPR119, OTC DPP4 120/4885FLT3 3747/4885SMN1; SMN2 1926/4885

“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.