SCHEMBL4797358

SCHEMBL4797358

CSc1ncnc2cc(-c3c(-c4ccccc4)ncn3C)oc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD3 Q9BZ95 1/20 0.43
TEK Q02763 4/20 0.41
FLT1 P17948 2/20 0.41
KDR P35968 2/20 0.41
TNIK Q9UKE5 1/20 0.37
NSD2 O96028 1/20 0.37
TGFBR1 P36897 2/20 0.34
ADORA2A P29274 1/20 0.34
MAPK14 Q16539 1/20 0.32
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
TSHR P16473 1/20 0.31
TGFBR2 P37173 1/20 0.30
LMNA P02545 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL4802696 0.84 TEK (0.53) NSD3TEKFLT1KDRTNIK
SCHEMBL4802131 0.76 TEK (0.55) NSD3TEKFLT1KDR
SCHEMBL4796150 0.70 TEK (0.72) NSD3TEKFLT1KDRTSHR
SCHEMBL4800419 0.70 TEK (0.58) NSD3TEKFLT1KDRTNIK
SCHEMBL4856226 0.70 HPGD (0.41) TEKFLT1KDRTSHRKDM4E
SCHEMBL4798739 0.68 NSD3 (0.49) NSD3TEKFLT1KDRTNIK
SCHEMBL4796320 0.68 TEK (0.72) NSD3TEKFLT1KDRTNIK
SCHEMBL1009513 0.68 NSD3 (0.83) NSD3TEKFLT1KDRTNIK
SCHEMBL29874438 0.66 NSD3 (0.80) NSD3TEKFLT1KDRTNIK
SCHEMBL19159679 0.64 NSD3 (0.51) NSD3TEKFLT1KDRTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7427616-B2 Condensed pyridines and pyrimidines with tie2 (TEK) activity ASTRAZENECA AB (SE) 2008-09-23 US disclosed
EP-1537112-B1 CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY ASTRAZENECA AB (SE) 2006-04-19 EP disclosed
US-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity ASTRAZENECA AB (SE) 2005-11-17 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 (1 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-20050256140-A1 Condensed pyridines and pyrimidines with tie2 (tek) activity TIE1, TEK, KDR NSD3 978/4885TEK 2/4885FLT1 6/4885

“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.