SCHEMBL28825328

SCHEMBL28825328

CC(C)(C)OC(=O)N1CC(C2CC2C(=O)O)C1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.56
PDE4B Q07343 2/20 0.41
RORC P51449 1/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GPR119 Q8TDV5 2/20 0.40
JAK1 P23458 2/20 0.39
JAK2 O60674 1/20 0.39
NAMPT P43490 1/20 0.39
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
HPGD P15428 1/20 0.38
EPHX2 P34913 1/20 0.38
KDM4E B2RXH2 1/20 0.37
RECQL P46063 1/20 0.36

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
SCHEMBL24367589 0.89 NR1H2 (0.55) NR1H2PDE4BRORCUSP2SMN1; SMN2
SCHEMBL5311614 0.84 NR1H2 (0.54) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL37879 0.84 NR1H2 (0.54) NR1H2PDE4BUSP2SMN1; SMN2GPR119
SCHEMBL13987271 0.84 GPR119 (0.53) USP2SMN1; SMN2GPR119HPGDRECQL
SCHEMBL7450072 0.84 GPR119 (0.53) USP2SMN1; SMN2GPR119HPGDRECQL
SCHEMBL1052921 0.83 NR1H2 (0.53) NR1H2PDE4BRORCUSP2SMN1; SMN2
SCHEMBL6065186 0.83 NR1H2 (0.53) NR1H2PDE4BRORCUSP2SMN1; SMN2
SCHEMBL1051376 0.83 NR1H2 (0.53) NR1H2PDE4BRORCUSP2SMN1; SMN2
SCHEMBL24814108 0.82 NR1H2 (0.48) NR1H2PDE4BRORCUSP2SMN1; SMN2
SCHEMBL30278408 0.81 NR1H2 (0.54) NR1H2PDE4BRORCUSP2SMN1; SMN2

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
CN-105315188-A Preparation method of 2-(1-(tertbutyloxycarbonyl)azacyclobutyl-3-yl)cyclopropanecarboxylic acid WUXI APPTEC CO LTD 2016-02-10 CN disclosed
CN-105315188-A Preparation method of 2-(1-(tertbutyloxycarbonyl)azacyclobutyl-3-yl)cyclopropanecarboxylic acid WUXI APPTEC CO LTD 2016-02-10 CN disclosed