SCHEMBL973121

SCHEMBL973121

CS(=O)(=O)c1nccc(-c2cccnc2Oc2ccc(Nc3nc4ccc(F)c(F)c4[nH]3)nc2)n1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TEK Q02763 9/20 0.41
PDE10A Q9Y233 3/20 0.40
AURKB Q96GD4 6/20 0.35
KDR P35968 5/20 0.35
AURKA O14965 5/20 0.35
LCK P06239 4/20 0.35
TPX2 Q9ULW0 1/20 0.33

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
SCHEMBL974031 0.86 TEK (0.56) TEKPDE10AAURKBKDRAURKA
SCHEMBL972134 0.86 TEK (0.42) TEKPDE10AAURKBKDRAURKA
SCHEMBL974465 0.84 TEK (0.41) TEKPDE10AAURKBKDRAURKA
SCHEMBL972655 0.76 TEK (0.57) TEKPDE10AAURKBKDRAURKA
SCHEMBL973891 0.70 TEK (0.56) TEKPDE10AAURKBKDRAURKA
SCHEMBL972866 0.70 PDE10A (0.76) TEKPDE10A
SCHEMBL973580 0.70 TEK (0.42) TEKPDE10AAURKBKDRAURKA
SCHEMBL2490704 0.69 PDE10A (0.49) TEKPDE10AKDR
SCHEMBL21811297 0.68 ERN1 (0.42) TEKKDR
SCHEMBL973995 0.67 TEK (0.74) TEKAURKBKDRAURKALCK

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 5 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 disclosed
EP-1994030-B1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC (US) 2010-08-25 EP disclosed
EP-1994030-A1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE Amgen Inc. (US) 2008-11-26 EP disclosed
US-20070213325-A1 Multi-cyclic compound and method of use AMGEN INC. (US) 2007-09-13 US disclosed
WO-2007100646-A1 MULTI-CYCLIC COMPOUNDS AND METHOD OF USE AMGEN INC. (US) 2007-09-07 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 (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 22/4885PDE10A 2613/4885AURKB 21/4885

“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.