SCHEMBL581012

SCHEMBL581012

N#CC(C=O)c1cccnc1Cl

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 3/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
FAAH O00519 7/20 0.33
NFE2L2 Q16236 4/20 0.33
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
CYP2C19 P33261 1/20 0.32
KCNH2 Q12809 1/20 0.32
MGLL Q99685 1/20 0.32
ALDH1A1 P00352 2/20 0.31

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
SCHEMBL27749866 0.74 SMN1; SMN2 (0.39) LMNASMN1; SMN2TRIM24TRIM33FAAH
SCHEMBL4591185 0.74 TRIM24 (0.40) LMNASMN1; SMN2TRIM24TRIM33FAAH
SCHEMBL20602053 0.74 TRIM24 (0.40) LMNASMN1; SMN2TRIM24TRIM33FAAH
Hydrochloric Acid SCHEMBL20601737 0.72 SMN1; SMN2 (0.38) LMNASMN1; SMN2TRIM24TRIM33FAAH
SCHEMBL6049601 0.72 PNMT (0.43) LMNAKDM4EKCNH2ALDH1A1
SCHEMBL26622019 0.72 MAPT (0.36) MAPTKDM4EALDH1A1
SCHEMBL28476071 0.70 MEN1 (0.45) LMNASMN1; SMN2MAPTKDM4EGAA
SCHEMBL27756905 0.70 SMN1; SMN2 (0.36) LMNASMN1; SMN2MAPTKDM4EGAA
SCHEMBL30440635 0.70 CFD (0.38) LMNAKDM4EGAAALDH1A1
SCHEMBL27714553 0.70 TRIM24 (0.37) LMNASMN1; SMN2TRIM24TRIM33FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9242961-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2016-01-26 US disclosed
EP-1984353-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2015-12-30 EP disclosed
EP-2418209-B1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC (US) 2014-06-25 EP disclosed
US-20140066430-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2014-03-06 US disclosed
EP-2418209-A1 Aurora kinase modulators and method of use Amgen Inc. (US) 2012-02-15 EP disclosed
US-20110263530-A1 Aurora Kinase Modulators and Method of Use AMGEN INC. (US) 2011-10-27 US disclosed
US-8022221-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2011-09-20 US disclosed
US-7560551-B2 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-07-14 US disclosed
US-20090163501-A1 Aurora kinase modulators and method of use AMGEN INC. (US) 2009-06-25 US disclosed
EP-1984353-A1 AURORA KINASE MODULATORS AND METHOD OF USE Amgen, Inc (US) 2008-10-29 EP disclosed
US-20070185111-A1 Aurora kinase modulators and method of use AMGEN INC. 2007-08-09 US disclosed
WO-2007087276-A1 AURORA KINASE MODULATORS AND METHOD OF USE AMGEN INC. (US) 2007-08-02 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-20140066430-A1 AURORA KINASE MODULATORS AND METHOD OF USE AURKC, AURKA, AURKB LMNA 620/4885SMN1; SMN2 3923/4885MAPT 2283/4885
US-20070185111-A1 Aurora kinase modulators and method of use AURKC, AURKA, CDK1 LMNA 637/4885SMN1; SMN2 3987/4885MAPT 1958/4885
US-20110263530-A1 Aurora Kinase Modulators and Method of Use AURKC, AURKA, AURKB LMNA 620/4885SMN1; SMN2 3923/4885MAPT 2283/4885
US-20090163501-A1 Aurora kinase modulators and method of use AURKC, AURKA, AURKB LMNA 620/4885SMN1; SMN2 3923/4885MAPT 2283/4885

“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.