SCHEMBL8069818

SCHEMBL8069818

CCCCCC1=C(O)CCC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 13/20 0.42
MPEG1 Q2M385 9/20 0.42
XIAP P98170 2/20 0.42
GPR84 Q9NQS5 2/20 0.42
ALDH1A1 P00352 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
PTGES O14684 1/20 0.42
USP2 O75604 1/20 0.42
TP53 P04637 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
MAPK1 P28482 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL15115450 0.98 ALOX5 (0.45) ALOX5MPEG1XIAPGPR84ALDH1A1
SCHEMBL15115447 0.98 ALOX5 (0.45) ALOX5MPEG1XIAPGPR84ALDH1A1
SCHEMBL7713557 0.89 ALOX5 (0.40) ALOX5MPEG1XIAPGPR84ALDH1A1
SCHEMBL11481269 0.80 LMNA (0.39) ALOX5ALDH1A1TDP1CYP2D6MAPT
SCHEMBL16276994 0.79
SCHEMBL16277018 0.78 ALDH1A1 (0.31) ALDH1A1TDP1LMNAPOLBRECQL
SCHEMBL7187409 0.78 SCD (0.40) ALOX5MPEG1XIAPGPR84ALDH1A1
SCHEMBL114204 0.78 ALDH1A1 (0.41) ALOX5MPEG1XIAPGPR84ALDH1A1
SCHEMBL4297676 0.77 ALDH1A1 (0.40) ALOX5MPEG1XIAPGPR84ALDH1A1
SCHEMBL10717166 0.76 ALDH1A1 (0.39) ALOX5MPEG1XIAPGPR84ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114042429-B Production device and method of natural delta decalactone spice 安徽华业香料股份有限公司 2024-12-10 CN claimed
CN-114042429-A Production device and method of natural delta-decalactone spice 安徽华业香料股份有限公司 2022-02-15 CN claimed
CN-216630783-U Production device of natural delta-decalactone spice 安徽华业香料股份有限公司 2022-05-31 CN disclosed
WO-2013105061-A1 FUSED DIHYDROPYRIDO [2,3 -B] PYRAZINES AS IP RECEPTOR AGONISTS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION (PAH) AND RELATED DISORDERS NOVARTIS AG (CH) 2013-07-18 WO disclosed
US-6150304-A HERBICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-11-21 US disclosed
US-6150304-A HERBICIDES, INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-11-21 US disclosed
EP-0769001-B1 2-ARYL CYCLOPENTANE-1,3-DIONE DERIVATIVES BAYER AG (DE) 2000-07-19 EP disclosed
US-5840661-A HERBICIDES OR INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
US-5840661-A HERBICIDES OR INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-11-24 US disclosed
EP-0769001-A1 2-ARYL CYCLOPENTANE-1,3-DIONE DERIVATIVES BAYER AG (DE) 1997-04-23 EP disclosed
WO-1996001798-A1 2-ARYL CYCLOPENTANE-1,3-DIONE DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1996-01-25 WO disclosed