SCHEMBL9733710

SCHEMBL9733710

COC(=O)C(CC(C)C)N1CC[C@@]2(CCCN2)C1=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
ADAM10 O14672 2/20 0.31
MMP1 P03956 2/20 0.31
MMP2 P08253 2/20 0.31
MMP3 P08254 2/20 0.31
MMP7 P09237 2/20 0.31
MMP9 P14780 2/20 0.31
MMP8 P22894 2/20 0.31
MMP13 P45452 2/20 0.31
MMP14 P50281 2/20 0.31
ADAM17 P78536 2/20 0.31
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
HTT P42858 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL9733714 1.00 POLB (0.33) POLBSLC6A2SLC6A4SLC6A3ADAM10
SCHEMBL1527326 0.86 SMN1; SMN2 (0.34) SLC6A2SLC6A4SLC6A3ADAM10MMP1
SCHEMBL13059971 0.86 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3
SCHEMBL1527328 0.86 SMN1; SMN2 (0.34) SLC6A2SLC6A4SLC6A3ADAM10MMP1
SCHEMBL9733830 0.83 SMN1; SMN2 (0.34) SLC6A2SLC6A4SLC6A3ADAM10MMP1
SCHEMBL13429355 0.83 SLC6A2 (0.30) SLC6A2SLC6A4SLC6A3
SCHEMBL3042987 0.83 ADAM17 (0.38) MMP2MMP9ADAM17
Hydrochloric Acid SCHEMBL3530197 0.83 MMP1 (0.36) MMP1MMP2MMP9ADAM17NPC1
SCHEMBL18806165 0.74
SCHEMBL7528133 0.74 MMP1 (0.36) MMP1MMP2MMP9ADAM17

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5166136-A SPIROLACTAM CONTAINING PEPTIDES GLAXO GROUP LIMITED (GB) 1992-11-24 US disclosed