SCHEMBL8670294

SCHEMBL8670294

COc1ccc(OC)c2c1C=CCC2

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 2/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
ADRA1A P35348 4/20 0.39
ACHE P22303 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
TXNRD1 Q16881 1/20 0.31

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
SCHEMBL7543660 0.86 KDM4E (0.39) KDM4EALDH1A1HPGDGAA
SCHEMBL7544301 0.85 KDM4E (0.46) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL7548035 0.81 ADORA3 (0.31) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL7548030 0.81 ALDH1A1 (0.32) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL7547552 0.81 ALDH1A1 (0.33) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL8908569 0.79 ADRA1A (0.42) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL3319373 0.74 DRD2 (0.40) ACHE
SCHEMBL30485650 0.74 DRD2 (0.40) ACHE
SCHEMBL13497561 0.74 PDE4B (0.36) KDM4EALDH1A1TXNRD1
SCHEMBL8729417 0.73 ACHE (0.45) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101885674-B Preparation method of 5,8-dimethoxy-2-tetralin ketone GANSU HAOTIAN CHEMEXPRESS CO LTD 2015-03-11 CN claimed
CN-101885674-A Preparation method of 5,8-dimethoxy-2-tetralin ketone GANSU HAOTIAN CHEMEXPRESS CO LTD 2010-11-17 CN claimed
CN-101885674-B Preparation method of 5,8-dimethoxy-2-tetralin ketone GANSU HAOTIAN CHEMEXPRESS CO LTD 2015-03-11 CN disclosed
CN-101885674-B Preparation method of 5,8-dimethoxy-2-tetralin ketone GANSU HAOTIAN CHEMEXPRESS CO LTD 2015-03-11 CN disclosed
CN-101885674-A Preparation method of 5,8-dimethoxy-2-tetralin ketone GANSU HAOTIAN CHEMEXPRESS CO LTD 2010-11-17 CN disclosed
CN-101885674-A Preparation method of 5,8-dimethoxy-2-tetralin ketone GANSU HAOTIAN CHEMEXPRESS CO LTD 2010-11-17 CN disclosed
EP-0883599-A1 AMINOTETRALIN DERIVATIVES AND COMPOSITIONS AND METHOD OF USE THEREOF ZENECA LIMITED (GB) 1998-12-16 EP disclosed
WO-1997031887-A1 AMINOTETRALIN DERIVATIVES AND COMPOSITIONS AND METHOD OF USE THEREOF ZENECA LIMITED (GB) 1997-09-04 WO disclosed