SCHEMBL18869837

SCHEMBL18869837

CC(C)[C@]1(N)CC1CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.52
GRM5 P41594 1/20 0.52
GRM1 Q13255 1/20 0.52
SLC6A12 P48065 3/20 0.34
SLC6A11 P48066 3/20 0.34
SLC6A13 Q9NSD5 3/20 0.34
SLC1A2 P43004 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
ALOX15 P16050 1/20 0.32
KMT2A Q03164 1/20 0.32
GRM4 Q14833 5/20 0.32
GRM8 O00222 3/20 0.32
GRM6 O15303 2/20 0.32

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
SCHEMBL16084399 0.69
SCHEMBL10924973 0.69
SCHEMBL16535275 0.68 GRM2 (1.00) GRM2GRM5GRM1GRM4GRM8
SCHEMBL8957597 0.64
SCHEMBL8957598 0.64
SCHEMBL23095576 0.64
SCHEMBL7557695 0.64
SCHEMBL15746434 0.63 GRM2 (0.37) GRM2GRM5GRM1SLC6A12SLC6A11
SCHEMBL25293228 0.63
SCHEMBL9390066 0.61

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-9650653-B2 Bioconversion process for producing nylon-7, nylon-7,7 and polyesters INVISTA NORTH AMERICA S.A.R.L. (US) 2017-05-16 US disclosed