SCHEMBL5167489

SCHEMBL5167489

CNc1cccc(N(C)C)c1C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.50
▸ POLB P06746 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA7 P43166 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ CA14 Q9ULX7 1/20 0.47
▸ F2 P00734 1/20 0.40
▸ PRSS1 P07477 1/20 0.40
▸ PRSS2 P07478 1/20 0.40
▸ PRSS3 P35030 1/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ GAA P10253 5/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ KCNQ2 O43526 1/20 0.39
▸ MAOA P21397 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ MAPT P10636 4/20 0.38

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
SCHEMBL5163934 0.83 KCNQ2 (0.40) KDM4EPOLBATMCA12CA1
SCHEMBL24572151 0.79 KMT2A (0.53) KDM4EPOLBATMCA12CA1
SCHEMBL27718440 0.78 CA12 (0.48) KDM4EPOLBCA12CA1CA2
SCHEMBL9609179 0.76 POLB (0.53) KDM4EPOLBATMCA12CA1
SCHEMBL22968584 0.76 KDM4E (0.53) KDM4EPOLBATMCA12CA1
SCHEMBL15966044 0.75 F2 (0.37) KDM4EPOLBATMF2PRSS1
SCHEMBL11359124 0.74 HPGD (0.44) KDM4EPOLBATMCA12CA1
2-Methylaminobenzoic Acid Methyl Ester SCHEMBL29991762 0.74 KDM4E (0.69) KDM4EPOLBATMKMT2AGAA
SCHEMBL10364185 0.73 CYP3A4 (0.43) KDM4EPOLBCA12CA1CA2
SCHEMBL24662642 0.70 CA1 (0.47) KDM4EPOLBATMCA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1224172-B1 DRUGS FOR THE TREATMENT OF MALIGNANT TUMOURS ACTIVE BIOTECH AB (SE) 2007-04-04 — — EP 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
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