SCHEMBL2149170

SCHEMBL2149170

COC(=O)/C=C/c1cccc(F)c1NC(=O)c1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
KDM4E B2RXH2 2/20 0.46
ALDH1A1 P00352 4/20 0.45
PDE4D Q08499 3/20 0.44
ALOX5 P09917 1/20 0.44
HDAC1 Q13547 1/20 0.43
TP53 P04637 3/20 0.41
MAPK1 P28482 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
F2 P00734 1/20 0.41
MCL1 Q07820 1/20 0.41
MAOB P27338 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL3599833 1.00 MEN1 (0.46) MEN1KMT2AKDM4EALDH1A1PDE4D
SCHEMBL2150013 0.85 ALDH1A1 (0.44) MEN1KMT2AKDM4EALDH1A1PDE4D
SCHEMBL3596581 0.85 ALDH1A1 (0.44) MEN1KMT2AKDM4EALDH1A1PDE4D
SCHEMBL2149214 0.84 ALDH1A1 (0.40) MEN1KMT2AKDM4EALDH1A1TP53
SCHEMBL3595123 0.84 ALDH1A1 (0.40) MEN1KMT2AKDM4EALDH1A1TP53
SCHEMBL15527872 0.79 TP53 (0.57) MEN1KMT2AALDH1A1PDE4DHDAC1
SCHEMBL3599836 0.78 HDAC1 (0.47) MEN1KMT2AKDM4EALDH1A1PDE4D
SCHEMBL28799137 0.78 KDM4E (0.49) MEN1KMT2AKDM4EALDH1A1TP53
SCHEMBL16810695 0.75 MEN1 (0.49) MEN1KMT2AKDM4EALDH1A1TP53
SCHEMBL14930494 0.73 PTGS2 (0.54) MEN1KMT2AKDM4EALDH1A1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1562913-B1 SUBSTITUTED QUINAZOLINES AS ANTIVIRAL AGENTS, ESPECIALLY AGAINST CYTOMEGALOVIRUSES AICURIS GMBH & CO KG (DE) 2011-07-13 EP disclosed
EP-1562913-B1 SUBSTITUTED QUINAZOLINES AS ANTIVIRAL AGENTS, ESPECIALLY AGAINST CYTOMEGALOVIRUSES AICURIS GMBH & CO KG (DE) 2011-07-13 EP disclosed
US-7709491-B2 Substituted quinazolines as antiviral agents, especially against cytomegaloviruses BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-05-04 US disclosed
US-7709491-B2 Substituted quinazolines as antiviral agents, especially against cytomegaloviruses BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-05-04 US disclosed
US-7709491-B2 Substituted quinazolines as antiviral agents, especially against cytomegaloviruses BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-05-04 US disclosed
US-20060235032-A1 Substituted quinazolines as antiviral agents, especially against cytomegaloviruses AIC246 AG & CO. KG (DE) 2006-10-19 US disclosed
EP-1562913-A1 SUBSTITUTED QUINAZOLINES AS ANTIVIRAL AGENTS, ESPECIALLY AGAINST CYTOMEGALOVIRUSES Bayer HealthCare AG (DE) 2005-08-17 EP disclosed
WO-2004041790-A1 SUBSTITUTED QUINAZOLINES AS ANTIVIRAL AGENTS, ESPECIALLY AGAINST CYTOMEGALOVIRUSES BAYER HEALTHCARE AG (DE) 2004-05-21 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-20060235032-A1 Substituted quinazolines as antiviral agents, especially against cytomegaloviruses TPMT, EIF2AK2, IRF3 MEN1 1290/4885KMT2A 2130/4885KDM4E 1877/4885

“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.