SCHEMBL3387671

SCHEMBL3387671

Cc1cc(OC(C)C)n(-c2ccc(Cl)cc2)n1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.69
SMN1; SMN2 Q16637 4/20 0.43
GAA P10253 4/20 0.43
HPGD P15428 4/20 0.43
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
PTGS2 P35354 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
LMNA P02545 5/20 0.40
MAPT P10636 4/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
ALPG P10696 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL3262792 0.84 MAPK1 (0.53) POLBSMN1; SMN2GAAHPGDALDH1A1
SCHEMBL3263786 0.83 POLB (0.46) POLBSMN1; SMN2GAAHPGDALDH1A1
SCHEMBL3386827 0.76 POLB (0.46) POLBHPGDALDH1A1L3MBTL1MAPT
SCHEMBL17051085 0.76 POLB (0.57) POLBSMN1; SMN2GAAHPGDALDH1A1
SCHEMBL3263163 0.75 POLB (0.46) POLBSMN1; SMN2HPGDALDH1A1L3MBTL1
SCHEMBL3264523 0.75 GRM1 (0.40) POLBALDH1A1L3MBTL1MEN1KMT2A
SCHEMBL12770967 0.74 POLB (0.64) POLBSMN1; SMN2GAAHPGDALDH1A1
SCHEMBL3263195 0.74 POLB (0.62) POLBSMN1; SMN2GAAHPGDALDH1A1
SCHEMBL9510331 0.73 POLB (0.61) POLBSMN1; SMN2GAAHPGDALDH1A1
SCHEMBL1143474 0.71 CYP1A2 (0.68) POLBSMN1; SMN2GAAHPGDALDH1A1

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-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed
EP-2151433-A1 Alkoxypyrazoles and the process for their preparation Institut Pasteur (FR) 2010-02-10 EP disclosed