SCHEMBL6636016

SCHEMBL6636016

CC(C)(C)OC(=O)N1C[C@@H](CCO)[C@@H](CCO)C1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.57
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PDE4B Q07343 2/20 0.43
NAMPT P43490 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
RECQL P46063 1/20 0.39
EPHX1 P07099 1/20 0.39
DDB1 Q16531 1/20 0.38
CRBN Q96SW2 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
RORC P51449 1/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL6636019 1.00 NR1H2 (0.57) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL17310854 0.95 NR1H2 (0.56) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL12877735 0.95 NR1H2 (0.53) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL12620811 0.95 NR1H2 (0.53) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL16963312 0.95 NR1H2 (0.56) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL16080212 0.92 NR1H2 (0.53) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL13052105 0.88 NR1H2 (0.47) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL19819953 0.86 NR1H2 (0.48) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL1277182 0.86 NR1H2 (0.61) NR1H2USP2SMN1; SMN2PDE4BNAMPT
SCHEMBL1014216 0.85 NR1H2 (0.65) NR1H2USP2SMN1; SMN2PDE4BNAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1061076-B1 N-ACYL CYCLIC AMINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2004-12-08 EP disclosed
EP-1061076-A1 N-ACYL CYCLIC AMINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-12-20 EP disclosed
US-6140333-A FOR TREATMENT AND/OR PROPHYLAXIS OF DISEASES INCLUDE SUCH RESPIRATORY DISEASES AS CHRONIC OBSTRUCTIVE PULMONARY DISEASES, CHRONIC BRONCHITIS, ASTHMA, CHRONIC RESPIRATORY OBSTRUCTION, PULMONARY FIBROSIS, PULMONARY EMPHYSEMA BANYU PHARMACEUTICAL CO LTD (JP) 2000-10-31 US disclosed