SCHEMBL9089853

SCHEMBL9089853

CNC(=O)NC1CC2(CCN(C(=O)O)CC2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.46
HSD11B2 P80365 3/20 0.44
MCHR2 Q969V1 8/20 0.44
DRD2 P14416 2/20 0.42
SLC6A4 P31645 2/20 0.42
KCNH2 Q12809 1/20 0.42
TRPV1 Q8NER1 1/20 0.37
UBA1 P22314 1/20 0.35
NAE1 Q13564 1/20 0.35
UBA3 Q8TBC4 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL8314152 0.85 NAE1 (0.47) HSD11B1MCHR2NAE1UBA3
SCHEMBL8100165 0.81 MCHR2 (0.42) HSD11B1HSD11B2MCHR2DRD2SLC6A4
SCHEMBL3545455 0.79 MCHR2 (0.56) HSD11B1HSD11B2MCHR2DRD2SLC6A4
SCHEMBL1223056 0.78 HSD11B1 (0.56) HSD11B1HSD11B2MCHR2KCNH2
SCHEMBL9395018 0.76 HSD11B1 (0.64) HSD11B1HSD11B2KCNH2
SCHEMBL5314192 0.75 HSD11B1 (0.47) HSD11B1HSD11B2MCHR2KCNH2
SCHEMBL5314195 0.75 HSD11B1 (0.47) HSD11B1HSD11B2MCHR2KCNH2
SCHEMBL1223765 0.73 HSD11B1 (0.56) HSD11B1HSD11B2KCNH2
SCHEMBL2758250 0.73 MCHR2 (0.60) HSD11B1HSD11B2MCHR2DRD2SLC6A4
SCHEMBL12385458 0.73 MCHR2 (0.50) MCHR2DRD2SLC6A4KCNH2NAE1

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-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 US disclosed