SCHEMBL30003715

SCHEMBL30003715

CCCCc1cc2c(cc1CCCC)C(=O)C(O)=CC2=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 9/20 0.47
MPEG1 Q2M385 7/20 0.47
ALDH1A1 P00352 5/20 0.47
XIAP P98170 4/20 0.47
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 3/20 0.47
GPR84 Q9NQS5 2/20 0.47
MAPK1 P28482 2/20 0.47
PTGES O14684 1/20 0.47
USP2 O75604 1/20 0.47
TP53 P04637 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
ALOX15 P16050 1/20 0.47
ALOX12 P18054 1/20 0.47
CYP2C19 P33261 1/20 0.47
KAT2B Q92831 1/20 0.47

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
SCHEMBL23271779 1.00 ALOX5 (0.47) ALOX5MPEG1ALDH1A1XIAPKDM4E
SCHEMBL23271936 0.81 ALDH1A1 (0.43) ALOX5ALDH1A1KDM4EMEN1KMT2A
SCHEMBL30003718 0.81 ALDH1A1 (0.43) ALOX5ALDH1A1KDM4EMEN1KMT2A
SCHEMBL30003420 0.80 PTPN1 (0.36) ALOX5XIAPTYRELANECTSG
SCHEMBL23271774 0.80 CTRC (0.39) ALOX5MPEG1XIAPTYRELANE
SCHEMBL30003394 0.80 PTPN1 (0.40) ALOX5XIAPKDM4ETYRELANE
SCHEMBL23271941 0.80 PTPN1 (0.36) ALOX5XIAPTYRELANECTSG
SCHEMBL23271932 0.80 PTPN1 (0.40) ALOX5XIAPKDM4ETYRELANE
SCHEMBL30003983 0.80 CTRC (0.39) ALOX5MPEG1XIAPTYRELANE
SCHEMBL23271747 0.80 XIAP (0.56) ALOX5MPEG1ALDH1A1XIAPKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed