SCHEMBL4134355

SCHEMBL4134355

CCOC(=O)CC(=O)CCc1cccc(-c2ccco2)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT6 Q96LA8 1/20 0.49
PSMB5 P28074 2/20 0.46
SYK P43405 5/20 0.43
PTPN7 P35236 1/20 0.42
KEAP1 Q14145 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
KDM4E B2RXH2 3/20 0.40
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ATM Q13315 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HPGD P15428 2/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 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
SCHEMBL4137181 0.90 PRMT6 (0.50) PRMT6PSMB5SYKPTPN7KEAP1
SCHEMBL11069047 0.79 KMT2A (0.49) SYKRAB9AKDM4EMAPTL3MBTL1
SCHEMBL10242910 0.78 PRMT6 (0.53) PRMT6PSMB5KEAP1KDM4EPOLB
SCHEMBL12302785 0.78 PRMT6 (0.59) PRMT6PSMB5KEAP1KDM4EPOLB
SCHEMBL10243163 0.77 PRMT6 (0.59) PRMT6PSMB5KEAP1NPC1RAB9A
SCHEMBL4640294 0.77 KEAP1 (0.56) PRMT6KEAP1KDM4EHPGDMEN1
SCHEMBL4151444 0.76 TAAR1 (0.45) MAPTL3MBTL1ALDH1A1
SCHEMBL4326400 0.76 FFAR1 (0.48) MAPTHPGDMEN1MAPK1KMT2A
SCHEMBL11066194 0.76 NPC1 (0.46) NPC1RAB9AKDM4EMAPTHPGD
SCHEMBL12303899 0.76 PRMT6 (0.51) PRMT6PSMB5KEAP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221579-A1 Substituted Amino-Compounds and Uses Thereof ASTEX THERAPEUTICS (GB) 2009-09-03 US disclosed
US-20090221579-A1 Substituted Amino-Compounds and Uses Thereof ASTEX THERAPEUTICS (GB) 2009-09-03 US disclosed
US-20090221579-A1 Substituted Amino-Compounds and Uses Thereof ASTEX THERAPEUTICS (GB) 2009-09-03 US disclosed
US-20090062282-A1 Substituted Amino-Pyrimidones and Uses Thereof ASTRAZENECA AB (SE) 2009-03-05 US disclosed
US-20090062282-A1 Substituted Amino-Pyrimidones and Uses Thereof ASTRAZENECA AB (SE) 2009-03-05 US disclosed
US-20090062282-A1 Substituted Amino-Pyrimidones and Uses Thereof ASTRAZENECA AB (SE) 2009-03-05 US disclosed
CN-101360722-A Novel 2-aminopyrimidine derivatives and their use ASTRAZENECA AB (SE) 2009-02-04 CN disclosed
US-20080255167-A1 Novel 2-Aminopyrimidine or 2-Aminiopyridinone Derivatives and Their Use ASTEX THERAPEUTICS LTD. (GB) 2008-10-16 US disclosed
US-20080255167-A1 Novel 2-Aminopyrimidine or 2-Aminiopyridinone Derivatives and Their Use ASTEX THERAPEUTICS LTD. (GB) 2008-10-16 US disclosed
US-20080255167-A1 Novel 2-Aminopyrimidine or 2-Aminiopyridinone Derivatives and Their Use ASTEX THERAPEUTICS LTD. (GB) 2008-10-16 US disclosed
EP-1951681-A1 NOVEL 2-AMINOPYRIMIDINE DERIVATIVES AND THEIR USE Astra Zeneca AB (SE) 2008-08-06 EP disclosed
EP-1802587-A1 SUBSTITUTED AMINO-COMPOUNDS AND USES THEREOF AstraZeneca AB (SE) 2007-07-04 EP disclosed
WO-2007058581-A1 NOVEL 2-AMINOPYRIMIDINE DERIVATIVES AND THEIR USE ASTRAZENECA AB (SE) 2007-05-24 WO disclosed
WO-2007058581-A1 NOVEL 2-AMINOPYRIMIDINE DERIVATIVES AND THEIR USE ASTRAZENECA AB (SE) 2007-05-24 WO disclosed
WO-2006041404-A1 SUBSTITUTED AMINO-COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2006-04-20 WO disclosed
WO-2006041404-A1 SUBSTITUTED AMINO-COMPOUNDS AND USES THEREOF ASTRAZENECA AB (SE) 2006-04-20 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 (3 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-20090221579-A1 Substituted Amino-Compounds and Uses Thereof APP, PSEN1, BACE1 PRMT6 553/4885PSMB5 187/4885SYK 2396/4885
US-20090062282-A1 Substituted Amino-Pyrimidones and Uses Thereof APP, PSEN1, PSEN2 PRMT6 1140/4885PSMB5 520/4885SYK 2804/4885
US-20080255167-A1 Novel 2-Aminopyrimidine or 2-Aminiopyridinone Derivatives and Their Use PSEN2, PSEN1, MAPT PRMT6 103/4885PSMB5 2378/4885SYK 3893/4885

“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.