SCHEMBL795337

SCHEMBL795337

Cc1cccc(N(C)c2nc(N)nc(C(=N)NO)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
CLK1 P49759 1/20 0.37
CLK2 P49760 1/20 0.37
DYRK1A Q13627 1/20 0.37
CLK4 Q9HAZ1 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
CSF1R P07333 3/20 0.36
TSHR P16473 2/20 0.36
RAB9A P51151 1/20 0.35
SIGMAR1 Q99720 2/20 0.34
F2 P00734 1/20 0.34
F10 P00742 1/20 0.34
EGFR P00533 3/20 0.33
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PDGFRB P09619 1/20 0.32
RXRA P19793 1/20 0.32

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
SCHEMBL17220075 0.87 HTR3E (0.44) CSF1REGFRRXRARXRBRXRG
SCHEMBL17220382 0.87 MEN1 (0.38) F2F10EGFRADORA2AADORA1
SCHEMBL795287 0.86 DHFR (0.41) SMN1; SMN2TSHRRAB9ALMNAMAPT
SCHEMBL17220373 0.85 MTNR1A (0.40) DYRK1APDGFRB
SCHEMBL17220235 0.85 DHFR (0.38) TSHR
SCHEMBL17220345 0.84 IDH2 (0.36) CSF1RTSHRF2F10EGFR
SCHEMBL795338 0.79 SIGMAR1 (0.39) SMN1; SMN2CLK1CLK2DYRK1ACLK4
SCHEMBL17220328 0.79 KCNH2 (0.37) RAB9ARXRA
SCHEMBL17220072 0.79 DHFR (0.31)
SCHEMBL17220006 0.78 SIGMAR1 (0.31) SIGMAR1

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 SMN1; SMN2 1684/4885CLK1 2305/4885CLK2 725/4885
US-20140051676-A1 Triazine-oxadiazoles OPRK1, OPRD1, OPRL1 SMN1; SMN2 1684/4885CLK1 2305/4885CLK2 725/4885

“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.