SCHEMBL28356949

SCHEMBL28356949

O=C1C=Cc2c(c(=O)c(=O)c(=O)c2=O)C1=O

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 3/20 0.32
▸ KDM4E B2RXH2 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ BCHE P06276 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ PTPRC P08575 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ THRB P10828 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ IDO1 P14902 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ PTPN1 P18031 1/20 0.30
▸ ACHE P22303 1/20 0.30
▸ RECQL P46063 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ PTPN22 Q9Y2R2 1/20 0.30

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
SCHEMBL30870314 0.66 CES1 (0.43) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL30288157 0.64 CES1 (0.50) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL11793572 0.64 CES1 (0.50) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL10906550 0.61 MEN1 (0.37) MEN1ALDH1A1LMNAPOLBMAPT
SCHEMBL48972 0.60 CDC25B (0.47) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL13010024 0.53 ALDH1A1 (0.33) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL4443898 0.52 CDC25B (0.39) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL31157962 0.51 TXNRD1 (0.71) KDM4EMEN1ALDH1A1LMNAPOLB
SCHEMBL4450124 0.50 AURKA (0.38) CES1KDM4EMEN1ALDH1A1LMNA
SCHEMBL10945354 0.50 MEN1 (0.38) CES1KDM4EMEN1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110628476-B Pretreatment method and purifying agent for refinery rich gas and desulfurization method for dry gas and/or liquefied gas 中国石油化工股份有限公司 2020-11-13 — — CN claimed
CN-110628476-A Pretreatment method and purifying agent for refinery rich gas and desulfurization method for dry gas and/or liquefied gas 中国石油化工股份有限公司 2019-12-31 — — CN claimed
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