SCHEMBL974793

SCHEMBL974793

CNc1nccc(-c2cccnc2Oc2ccc(Nc3nc4ccccc4n3C)cc2)n1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TEK Q02763 6/20 0.70
KDR P35968 5/20 0.70
PDE10A Q9Y233 4/20 0.66
AURKB Q96GD4 10/20 0.58
AURKA O14965 5/20 0.58
TPX2 Q9ULW0 3/20 0.58
PTK2 Q05397 2/20 0.52
AKT1 P31749 1/20 0.52
PLK1 P53350 1/20 0.52
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
LCK P06239 2/20 0.48

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
SCHEMBL973732 0.89 TEK (0.62) TEKKDRPDE10AAURKBAURKA
SCHEMBL972856 0.87 TEK (0.71) TEKKDRPDE10AAURKBAURKA
SCHEMBL972094 0.86 TEK (0.54) TEKKDRPDE10AAURKBAURKA
SCHEMBL581474 0.81 TEK (0.68) TEKAURKBAURKATPX2
SCHEMBL973158 0.80 PDE10A (0.72) TEKKDRPDE10AAURKBAURKA
SCHEMBL2489700 0.80 PDE10A (1.00) PDE10ANPC1RAB9A
SCHEMBL2491583 0.80 PDE10A (0.71) TEKKDRPDE10AAURKBPTK2
SCHEMBL974603 0.79 AURKB (0.70) TEKKDRPDE10AAURKBAURKA
SCHEMBL974493 0.79 TEK (1.00) TEKKDRPDE10AAURKBAURKA
SCHEMBL2490606 0.79 PDE10A (1.00) PDE10ANPC1RAB9A

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
US-7868177-B2 Multi-cyclic compounds and method of use AMGEN INC. (US) 2011-01-11 US claimed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP claimed
EP-1994030-A1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE Amgen Inc. (US) 2008-11-26 EP claimed
US-20070213325-A1 Multi-cyclic compound and method of use AMGEN INC. (US) 2007-09-13 US claimed
WO-2007100646-A1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC. (US) 2007-09-07 WO claimed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP 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-20070213325-A1 Multi-cyclic compound and method of use TIE1, CDK1, CCNB1 TEK 22/4885KDR 12/4885PDE10A 2613/4885

“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.