SCHEMBL5167218

SCHEMBL5167218

CN(C)c1ccc2c(c1)c(=O)oc(=O)n2C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 4/20 0.44
HPGD P15428 4/20 0.44
HSD17B10 Q99714 3/20 0.44
MAPT P10636 3/20 0.44
THRB P10828 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
GLA P06280 1/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ELANE P08246 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
CCR4 P51679 1/20 0.39
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
SLC16A3 O15427 1/20 0.36
IP6K1 Q92551 1/20 0.36
MAPK1 P28482 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL5525919 0.78 KDM4E (0.45) ALDH1A1KDM4EMAPTNPSR1ELANE
SCHEMBL29811263 0.78 KDM4E (0.45) ALDH1A1KDM4EMAPTNPSR1ELANE
SCHEMBL29811258 0.77 PKM (0.44) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL607256 0.77 PKM (0.44) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL29811590 0.77 ALDH1A1 (0.37) ALDH1A1KDM4EHPGDKMT2AMEN1
SCHEMBL4822294 0.77 ATM (0.45) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL2384145 0.77 ESR2 (0.41) ALDH1A1HPGDMAPTSMN1; SMN2CA12
SCHEMBL29811388 0.77 ATM (0.45) ALDH1A1KDM4EHPGDHSD17B10SMN1; SMN2
SCHEMBL22239410 0.77 PDE2A (0.46) ALDH1A1HPGDNPSR1
SCHEMBL29811309 0.77 ESR2 (0.41) ALDH1A1HPGDMAPTSMN1; SMN2CA12

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-116655543-A Preparation method of ulcerative colitis treatment medicine 北京康立生医药技术开发有限公司 2023-08-29 CN disclosed
CN-100390148-C Method for the treatment of malignant tumours ACTIVE BIOTECH AB (SE) 2008-05-28 CN disclosed
EP-1224172-B1 DRUGS FOR THE TREATMENT OF MALIGNANT TUMOURS ACTIVE BIOTECH AB (SE) 2007-04-04 EP disclosed
CN-1589264-A Method for the treatment of malignant tumours ACTIVE BIOTECH AB (SE) 2005-03-02 CN disclosed
US-6605616-B1 Autoimmune diseases; inflammation ACTIVE BIOTECH AB (SE) 2003-08-12 US disclosed
EP-1224172-A1 DRUGS FOR THE TREATMENT OF MALIGNANT TUMOURS Active Biotech AB (SE) 2002-07-24 EP disclosed
US-6395750-B1 Includes laquinimod, N-ethyl-N-phenyl-1,2-dihydro-4-hydroxy-5-chloro-1-methyl-2-oxo-quinoline-3-carboxamide and its salts; breat or prostate cancer ACTIVE BIOTECH AB (SE) 2002-05-28 US disclosed
WO-2001030758-A1 DRUGS FOR THE TREATMENT OF MALIGNANT TUMOURS ACTIVE BIOTECH AB (SE) 2001-05-03 WO disclosed