SCHEMBL3429282

SCHEMBL3429282

CCOC(=O)Oc1cc(-c2cccc(Cl)c2)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.49
MGLL Q99685 1/20 0.49
CHRNA7 P36544 2/20 0.47
DYRK3 O43781 1/20 0.45
DYRK1A Q13627 1/20 0.45
DYRK2 Q92630 1/20 0.45
DYRK1B Q9Y463 1/20 0.45
SLC16A3 O15427 2/20 0.44
SLC16A1 P53985 2/20 0.44
MALT1 Q9UDY8 3/20 0.44
MCTS1 Q9ULC4 1/20 0.44
PPP1CA P62136 2/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
PTGS2 P35354 1/20 0.43
CCKAR P32238 1/20 0.43
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43

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
SCHEMBL3425186 0.93 CHRNA7 (0.45) FAAHMGLLCHRNA7DYRK3DYRK1A
SCHEMBL3431896 0.91 FAAH (0.47) FAAHMGLLCHRNA7SLC16A3SLC16A1
SCHEMBL3431433 0.88 RXRA (0.47) FAAHMGLLCHRNA7SLC16A3SLC16A1
SCHEMBL1110698 0.88 PPP1CA (0.50) FAAHCHRNA7SLC16A3SLC16A1MCTS1
SCHEMBL3430227 0.87 ALDH1A1 (0.45) FAAHMGLLCHRNA7DYRK3DYRK1A
SCHEMBL3434465 0.86 ALDH1A1 (0.44) CHRNA7DYRK3DYRK1ADYRK2DYRK1B
SCHEMBL3426584 0.85 SLC16A3 (0.57) FAAHMGLLSLC16A3SLC16A1MCTS1
SCHEMBL3427612 0.85 NPY5R (0.47) FAAHDYRK3DYRK1ADYRK2DYRK1B
SCHEMBL3434918 0.85 ALDH1A1 (0.40) FAAHMGLLCHRNA7DYRK3DYRK1A
SCHEMBL1110649 0.85 ALDH1A1 (0.44) FAAHCHRNA7DYRK3DYRK1ADYRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2254885-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AiCuris GmbH & Co. KG (DE) 2010-12-01 EP disclosed
WO-2009115213-A1 (PYRAZOLYL CARBONYL)IMIDAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF RETROVIRAL DISEASES AICURIS GMBH & CO. KG (DE) 2009-09-24 WO disclosed