SCHEMBL2581089

SCHEMBL2581089

CCN(CC)CCN1C(=O)C(O)(c2ccccc2Cl)c2ccc(C=O)cc21

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 15/20 0.55
SCN9A Q15858 2/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
HTR1A P08908 1/20 0.36
DRD3 P35462 1/20 0.36
OPRK1 P41145 1/20 0.36
HTR3A P46098 1/20 0.36
KCNH2 Q12809 1/20 0.36
POLB P06746 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
SCHEMBL5051659 0.84 GHSR (0.70) GHSRTP53POLB
SCHEMBL7840414 0.81 GHSR (0.63) GHSRTP53MAPTPOLB
SCHEMBL5050576 0.80 GHSR (0.63) GHSRHTR1ADRD3OPRK1HTR3A
SCHEMBL6178849 0.79 GHSR (0.64) GHSRTP53MAPTPOLB
SCHEMBL6180297 0.78 GHSR (0.60) GHSRTP53MAPT
SCHEMBL6177564 0.78 GHSR (0.62) GHSRTP53MAPTPOLB
SCHEMBL17521418 0.76 GHSR (0.58) GHSRTP53MAPT
SCHEMBL2579878 0.76 GHSR (0.72) GHSRHTR1ADRD3OPRK1HTR3A
SCHEMBL6181657 0.75 GHSR (0.59) GHSRTP53MAPT
SCHEMBL6178340 0.75 GHSR (0.59) GHSRTP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2389941-A1 Growth-hormone secretagogues Elixir Pharmaceuticals, Inc. (US) 2011-11-30 EP disclosed
EP-1781311-A2 GROWTH-HORMONE SECRETAGOGUES Elixir Pharmaceuticals, Inc. (US) 2007-05-09 EP disclosed
WO-2006023608-A2 GROWTH-HORMONE SECRETAGOGUES ELIXIR PHARMACEUTICALS, INC. (US) 2006-03-02 WO disclosed
US-6576656-B1 Such as 1-(2-diethylaminoethyl)-4-trifluoromethyl-6-carbamoyl-3-hydroxy-3-(2 -chlorophenyl)oxindole; growth hormone releaser SUMITOMO PHARMACEUTICALS CO., LTD. (JP) 2003-06-10 US disclosed