SCHEMBL580365

SCHEMBL580365

Clc1nnc(-c2ccccc2)c2c1CCC2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
MAPK10 P53779 1/20 0.46
PTGS2 P35354 6/20 0.42
PTGS1 P23219 5/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 3/20 0.40
PKM P14618 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ADORA2B P29275 1/20 0.36
PARP1 P09874 1/20 0.35
GAA P10253 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL580172 0.96 MEN1 (0.44) LMNAMAPK10PTGS2PTGS1MEN1
SCHEMBL18137230 0.82 PTGS2 (0.51) LMNAMAPK10PTGS2PTGS1MEN1
SCHEMBL4094970 0.82 PTGS2 (0.51) LMNAMAPK10PTGS2PTGS1MEN1
SCHEMBL581560 0.74 MAPK1 (0.32) MEN1KMT2AKDM4E
SCHEMBL30375516 0.74 MAPK1 (0.32) MEN1KMT2AKDM4E
SCHEMBL17694188 0.73 HSD17B10 (0.48) LMNAMAPK10PTGS2PTGS1MEN1
SCHEMBL21553936 0.73 PTGS2 (0.44) LMNAMAPK10PTGS2PTGS1MEN1
SCHEMBL1830196 0.70 FLT1 (0.43) LMNAMEN1KMT2APKMSMN1; SMN2
SCHEMBL9138181 0.70 KDM4E (0.47) LMNAKDM4EPKMSMN1; SMN2ALDH1A1
SCHEMBL30101051 0.70 MAPK1 (0.37) LMNAMEN1KMT2AKDM4ESMN1; SMN2

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 620/4885MAPK10 1365/4885PTGS2 4056/4885
US-20070185111-A1 Aurora kinase modulators and method of use AURKC, AURKA, CDK1 LMNA 637/4885MAPK10 1051/4885PTGS2 2775/4885
US-20110263530-A1 Aurora Kinase Modulators and Method of Use AURKC, AURKA, AURKB LMNA 620/4885MAPK10 1365/4885PTGS2 4056/4885
US-20090163501-A1 Aurora kinase modulators and method of use AURKC, AURKA, AURKB LMNA 620/4885MAPK10 1365/4885PTGS2 4056/4885

“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.