SCHEMBL2210282

SCHEMBL2210282

COc1cnc2c(Oc3ccc(Nc4nnc(-c5cccc(C#N)c5)c5ccccc45)cc3)ccnc2c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA9 Q16790 1/20 0.45
MAPT P10636 4/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.42
KDR P35968 2/20 0.42
FGFR2 P21802 2/20 0.42
ABCG2 Q9UNQ0 5/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ENPP3 O14638 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
AURKA O14965 1/20 0.40
AURKB Q96GD4 1/20 0.40
TPX2 Q9ULW0 1/20 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
SCHEMBL2972776 0.92 MAPT (0.49) CA9MAPTLMNATP53KDR
SCHEMBL2965227 0.90 CA9 (0.55) CA9MAPTLMNATP53KDR
SCHEMBL2204168 0.89 MAPT (0.53) CA9MAPTLMNATP53KDR
SCHEMBL2981073 0.89 CA9 (0.47) CA9MAPTLMNATP53KDR
SCHEMBL2981577 0.88 CA9 (0.47) CA9MAPTLMNATP53KDR
SCHEMBL2209836 0.87 MAPT (0.58) CA9MAPTLMNATP53KDR
SCHEMBL2966741 0.87 MAPT (0.44) CA9MAPTLMNATP53KDR
SCHEMBL2978907 0.86 CA9 (0.45) CA9MAPTLMNATP53KDR
SCHEMBL15663727 0.86 MAPT (0.48) CA9MAPTLMNATP53KDR
SCHEMBL2209401 0.86 AURKA (0.46) CA9MAPTLMNATP53FGFR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140336182-A1 Aurora Kinase Modulators and Method of Use AMGEN INC (US) 2014-11-13 US disclosed
EP-2137177-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-05-07 EP disclosed
US-8557816-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2013-10-15 US disclosed
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2012-05-17 US disclosed
US-7981891-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2011-07-19 US disclosed
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2010-11-04 US disclosed
US-7776857-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2010-08-17 US disclosed
EP-2137177-A2 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2009-12-30 EP disclosed
US-20090069297-A1 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-03-12 US disclosed
WO-2008124083-A2 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2008-10-16 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 (4 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-20140336182-A1 Aurora Kinase Modulators and Method of Use AURKC, AURKA, CDK1 CA9 1947/4885MAPT 1693/4885LMNA 796/4885
US-20090069297-A1 Aurora kinase modulators and method of use AURKC, AURKA, CDK1 CA9 1947/4885MAPT 1693/4885LMNA 796/4885
US-20100280008-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 CA9 1947/4885MAPT 1693/4885LMNA 796/4885
US-20120122847-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, CDK1 CA9 1947/4885MAPT 1693/4885LMNA 796/4885

“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.