SCHEMBL6835962

SCHEMBL6835962

Cc1cccc2c1CCC(=O)O2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
CYP1A2 P05177 1/20 0.50
GLA P06280 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
SIRT1 Q96EB6 1/20 0.50
HSD17B10 Q99714 1/20 0.50
PARP1 P09874 1/20 0.40
PARP10 Q53GL7 1/20 0.40
PARP11 Q9NR21 1/20 0.40
ALDH2 P05091 1/20 0.37
ALDH3A1 P30838 1/20 0.37
MAPT P10636 2/20 0.37
TSHR P16473 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
THRB P10828 1/20 0.37
KMT2A Q03164 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL21605346 0.82 MAPT (0.38) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL6838741 0.78 KDM4E (0.47) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL6838805 0.77 HPGD (0.50) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL8777243 0.77 KDM4E (0.50) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL7492572 0.77 KDM4E (0.50) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL11828824 0.77 HPGD (0.50) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL32672839 0.77 KDM4E (0.50) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL834241 0.73 ALDH2 (0.37) KDM4EHPGDPARP1PARP10PARP11
SCHEMBL6832823 0.73 ALDH2 (0.41) KDM4ECYP1A2GLACYP2C9HPGD
SCHEMBL6838797 0.73 KDM4E (0.46) KDM4ECYP1A2GLACYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5639893-A Process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-17 US claimed
EP-0757989-A1 A process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-02-12 EP claimed
US-5300662-A Process for producing coumarin and derivatives thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-04-05 US claimed
US-6756432-B2 POLYBUTADIENE TYPE POLYMER WITH A 1-BENZOPYRAN, A 1-BENZO PYRAN-2-ONE OR A BENZOIN DERIVATIVE; MOLDS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-06-29 US disclosed
US-20030153655-A1 Polybutadiene composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-08-14 US disclosed
EP-0539181-B1 Process for producing coumarin and derivatives thereof SUMITOMO CHEMICAL CO (JP) 1997-06-18 EP disclosed
US-5639893-A Process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-17 US disclosed
EP-0757989-A1 A process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-02-12 EP disclosed
US-5300662-A Process for producing coumarin and derivatives thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-04-05 US disclosed
EP-0539181-A1 Process for producing coumarin and derivatives thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-04-28 EP disclosed