SCHEMBL838271

SCHEMBL838271

CN(CCNC(=O)O)c1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
PPARG P37231 2/20 0.46
PPARA Q07869 2/20 0.46
CYP2D6 P10635 2/20 0.45
CYP2C19 P33261 2/20 0.45
MEN1 O00255 3/20 0.45
CKS1B P61024 1/20 0.44
SKP1 P63208 1/20 0.44
SKP2 Q13309 1/20 0.44
ALOX15 P16050 1/20 0.43
POLB P06746 1/20 0.43
CHRM2 P08172 2/20 0.42
ADRA2B P18089 2/20 0.42
SLC6A2 P23975 2/20 0.42
SLC6A3 Q01959 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2C P18825 1/20 0.42
DRD1 P21728 1/20 0.42
HTR2A P28223 1/20 0.42
SLC6A4 P31645 1/20 0.42

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
SCHEMBL13135503 0.88 MTNR1A (0.52) KMT2APPARGPPARACYP2D6CYP2C19
SCHEMBL13115922 0.84 KMT2A (0.46) KMT2APPARGPPARACYP2D6CYP2C19
SCHEMBL19642981 0.83 PPARG (0.49) KMT2APPARGPPARACYP2D6CYP2C19
SCHEMBL837529 0.81 CKS1B (0.64) KMT2APPARGPPARACYP2D6CYP2C19
SCHEMBL726956 0.79 CYP2C19 (0.51) KMT2APPARGPPARACYP2D6CYP2C19
SCHEMBL14485337 0.79 HCAR3 (0.49) CKS1BSKP1SKP2HDAC1HDAC2
Hydrochloric Acid SCHEMBL27281780 0.78 LMNA (0.50) KMT2APPARGPPARACYP2D6CYP2C19
SCHEMBL4743411 0.77 ALDH1A1 (0.51) KMT2ACYP2D6CYP2C19MEN1POLB
SCHEMBL14485788 0.77 HCAR3 (0.47) KMT2ACKS1BSKP1SKP2HDAC1
SCHEMBL13536824 0.76 CYP2C19 (0.49) KMT2APPARGPPARACYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143251-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2012-03-27 US disclosed
US-20110144113-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION 2011-06-16 US disclosed
US-7915408-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2011-03-29 US disclosed
US-20100130467-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION 2010-05-27 US disclosed
US-7683060-B2 Triazolotriazines as kinase inhibitors INCYTE CORPORATION (US) 2010-03-23 US disclosed
EP-2057164-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS Incyte Corporation (US) 2009-05-13 EP disclosed
WO-2008021781-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-02-21 WO disclosed
US-20080039457-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-02-14 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 (3 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-20080039457-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET KMT2A 403/4885PPARG 2093/4885PPARA 3461/4885
US-20100130467-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET KMT2A 403/4885PPARG 2093/4885PPARA 3461/4885
US-20110144113-A1 TRIAZOLOTRIAZINES AS KINASE INHIBITORS MET, ERBB2, RET KMT2A 403/4885PPARG 2093/4885PPARA 3461/4885

“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.