SCHEMBL795407

SCHEMBL795407

CN(Cc1ccccc1)c1nc(N)nc(C#N)n1

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
LMNA P02545 2/20 0.58
TSHR P16473 1/20 0.58
DHFR P00374 1/20 0.45
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
RAB9A P51151 1/20 0.44
CSNK2A1 P68400 1/20 0.44
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CTSK P43235 1/20 0.40

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
SCHEMBL14869399 0.85 SMN1; SMN2 (0.58) MAPTSMN1; SMN2LMNATSHRDHFR
SCHEMBL14869432 0.79 SMN1; SMN2 (0.52) MAPTSMN1; SMN2LMNATSHRDHFR
SCHEMBL796039 0.78 MAPT (0.72) MAPTSMN1; SMN2LMNATSHRDHFR
SCHEMBL795874 0.78 SMN1; SMN2 (0.58) MAPTSMN1; SMN2LMNATSHRDHFR
SCHEMBL14869415 0.75 SMN1; SMN2 (0.49) MAPTSMN1; SMN2LMNADHFRNPSR1
SCHEMBL796235 0.74 MAPT (0.81) MAPTSMN1; SMN2LMNATSHRDHFR
SCHEMBL13363710 0.74 MAPT (1.00) MAPTSMN1; SMN2LMNATSHRCRHBP
SCHEMBL17220220 0.71 MAPT (0.55) MAPTSMN1; SMN2LMNATSHRCRHBP
SCHEMBL17220372 0.71 MAPT (0.67) MAPTSMN1; SMN2LMNATSHRDHFR
SCHEMBL17220070 0.71 SMN1; SMN2 (0.45) MAPTSMN1; SMN2LMNATSHRDHFR

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
EP-2616465-B1 TRIAZINE-OXADIAZOLES NOVARTIS AG (CH) 2015-11-04 EP disclosed
US-20150025057-A1 Triazine-oxadiazoles NOVARTIS AG (CH) 2015-01-22 US disclosed
US-8895733-B2 Triazine-oxadiazoles NOVARTIS AG (CH) 2014-11-25 US disclosed
US-20140051676-A1 Triazine-oxadiazoles NOVARTIS AG (CH) 2014-02-20 US disclosed
EP-2616465-A1 TRIAZINE-OXADIAZOLES Novartis AG (CH) 2013-07-24 EP disclosed
WO-2012035023-A1 TRIAZINE-OXADIAZOLES NOVARTIS AG (CH) 2012-03-22 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-20150025057-A1 Triazine-oxadiazoles OPRK1, OPRD1, OPRL1 MAPT 2602/4885SMN1; SMN2 1684/4885LMNA 4798/4885
US-20140051676-A1 Triazine-oxadiazoles OPRK1, OPRD1, OPRL1 MAPT 2602/4885SMN1; SMN2 1684/4885LMNA 4798/4885

“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.