SCHEMBL795198

SCHEMBL795198

Nc1nc(Nc2ccccc2)nc(-c2noc(C(Cl)(Cl)Cl)n2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 1/20 0.48
MAPT P10636 7/20 0.48
NPC1 O15118 7/20 0.48
RAB9A P51151 7/20 0.48
KMT2A Q03164 6/20 0.48
HTT P42858 4/20 0.48
KDM4E B2RXH2 7/20 0.47
MEN1 O00255 5/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
ALDH1A1 P00352 2/20 0.47
USP2 O75604 2/20 0.47
ALOX15 P16050 2/20 0.47
TSHR P16473 2/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
BCL6 P41182 1/20 0.42
L3MBTL1 Q9Y468 3/20 0.41
LMNA P02545 1/20 0.40
MAPK1 P28482 4/20 0.40
NFKB1 P19838 2/20 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
SCHEMBL15477215 0.86 RAB9A (0.43) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL794305 0.76 KDM4E (0.53) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL796837 0.76 CDK9 (0.46) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL795266 0.75 CDK9 (0.47) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL795357 0.74 ADORA2A (0.47) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL795935 0.74 RAB9A (0.48) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL855684 0.74 ADORA3 (0.62) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL19227719 0.74 ADORA3 (0.62) CDK9MAPTNPC1RAB9AKMT2A
SCHEMBL795209 0.73 DHFR (0.37) MAPTNPC1RAB9AKMT2ASMN1; SMN2
SCHEMBL15477225 0.73 MAPT (0.50) CDK9MAPTNPC1RAB9AKMT2A

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 CDK9 1967/4885MAPT 2602/4885NPC1 3204/4885
US-20140051676-A1 Triazine-oxadiazoles OPRK1, OPRD1, OPRL1 CDK9 1967/4885MAPT 2602/4885NPC1 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.