SCHEMBL821923

SCHEMBL821923

CCCCCC1=CC(=O)N(C(=O)O)C1=O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.41
BACE1 P56817 1/20 0.41
ALDH1A1 P00352 1/20 0.38
ALOX5 P09917 7/20 0.37
PTGS2 P35354 5/20 0.37
PTPN1 P18031 1/20 0.36
GLS2 Q9UI32 1/20 0.36
KAT8 Q9H7Z6 2/20 0.36
PPARA Q07869 1/20 0.36
RARB P10826 2/20 0.35
GPR84 Q9NQS5 1/20 0.34
SCD O00767 1/20 0.34
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
MPEG1 Q2M385 1/20 0.34

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
SCHEMBL28380782 0.98 ACHE (0.44) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL3798998 0.82 XPO1 (0.32)
SCHEMBL1535485 0.77 ACHE (0.44) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL28098556 0.76 ACHE (0.47) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL1535467 0.76 ACHE (0.47) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL28098404 0.76 ACHE (0.47) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL4330983 0.75 ACHE (0.46) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL5203852 0.74 ACHE (0.44) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL4005408 0.74 ACHE (0.49) ACHEBACE1ALDH1A1ALOX5PTGS2
SCHEMBL505900 0.72 PTGS2 (0.52) ACHEBACE1ALDH1A1ALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2177541-B1 PROCESS FOR PRODUCTION OF NUCLEUS-HYDROGENATED AROMATIC VINYL /(METH)ACRYLATE COPOLYMERS MITSUBISHI GAS CHEMICAL CO (JP) 2013-12-18 EP disclosed
US-8575277-B2 Process for production of nucleus-hydrogenated aromatic vinyl/(meth)acrylate copolymers MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2013-11-05 US disclosed
US-20110269912-A1 PROCESS FOR PRODUCTION OF NUCLEUS-HYDROGENATED AROMATIC VINYL/(METH)ACRYLATE COPOLYMERS MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2011-11-03 US disclosed
EP-2177541-A1 PROCESS FOR PRODUCTION OF NUCLEUS-HYDROGENATED AROMATIC VINYL /(METH)ACRYLATE COPOLYMERS Mitsubishi Gas Chemical Company, Inc. (JP) 2010-04-21 EP disclosed