SCHEMBL795300

SCHEMBL795300

CC(C)S(=O)(=O)N1CCC(c2nc(-c3nc(N)nc(Nc4ccccc4)n3)no2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.42
HTT P42858 4/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SCN9A Q15858 2/20 0.41
TSHR P16473 4/20 0.41
HSD17B10 Q99714 2/20 0.41
GAA P10253 3/20 0.41
SMN1; SMN2 Q16637 8/20 0.39
KDM4E B2RXH2 2/20 0.39
SMO Q99835 1/20 0.39
MAPT P10636 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
CYP2C9 P11712 1/20 0.38
APEX1 P27695 1/20 0.38

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
SCHEMBL797212 0.91 LMNA (0.43) LMNAHTTNPC1RAB9ASCN9A
SCHEMBL795398 0.88 LMNA (0.44) LMNAHTTNPC1RAB9ASCN9A
SCHEMBL796081 0.87 LMNA (0.42) LMNAHTTNPC1RAB9ASCN9A
SCHEMBL795707 0.86 TSHR (0.42) LMNAHTTNPC1RAB9ASCN9A
SCHEMBL15477347 0.82 GAA (0.42) LMNAHTTNPC1RAB9ATSHR
SCHEMBL795576 0.78 GPR119 (0.45) SCN9AGAASMN1; SMN2KDM4ESMO
Hydrochloric Acid SCHEMBL17220234 0.77 NR1H4 (0.49) HTTNPC1RAB9ASCN9ATSHR
SCHEMBL15477137 0.77 LMNA (0.40) LMNAHTTNPC1RAB9ATSHR
SCHEMBL795606 0.74 LMNA (0.42) LMNAHTTNPC1RAB9ATSHR
SCHEMBL15477390 0.72 GRM5 (0.38) LMNAHTTTSHRHSD17B10GAA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616465-B1 TRIAZINE-OXADIAZOLES NOVARTIS AG (CH) 2015-11-04 EP disclosed
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-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-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
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 LMNA 4798/4885HTT 3966/4885NPC1 3204/4885
US-20140051676-A1 Triazine-oxadiazoles OPRK1, OPRD1, OPRL1 LMNA 4798/4885HTT 3966/4885NPC1 3204/4885

“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.