SCHEMBL8311798

SCHEMBL8311798

O=C(O)N1CCC2(CC1)c1ccccc1-c1ccccc12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
OPRM1 P35372 1/20 0.43
PDK2 Q15119 4/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40
RECQL P46063 1/20 0.40
APEX1 P27695 1/20 0.40
MEN1 O00255 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL9052325 0.79 OPRM1 (0.58) OPRM1KMT2AMEN1
SCHEMBL15969314 0.77 SMN1; SMN2 (0.40) PDK2ALDH1A1TP53MAPT
SCHEMBL2802804 0.77 HRH3 (0.55) THRBTDP1OPRM1ALDH1A1
SCHEMBL4979700 0.76 OPRM1 (0.54) OPRM1KMT2AMEN1
SCHEMBL2801416 0.76 OPRM1 (0.41) OPRM1KMT2AALDH1A1MEN1USP2
SCHEMBL2315258 0.76 OPRM1 (0.54) OPRM1KMT2AMEN1
SCHEMBL4365551 0.74 NPY5R (0.58) ALDH1A1
SCHEMBL2803156 0.74 MEN1 (0.37) KMT2AALDH1A1TSHRMEN1USP2
SCHEMBL4365548 0.74 NPY5R (0.58) ALDH1A1
SCHEMBL23647576 0.73 HDAC4 (0.42) OPRM1KMT2AMEN1

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-0662481-B1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO INC (US) 1999-03-24 EP disclosed
US-5578593-A RELEASING GROWTH HORMONES FOR ANIMALS MERCK & CO., INC. (US) 1996-11-26 US disclosed
EP-0662481-A1 Spiro piperidines and homologs promote release of growth hormone MERCK & CO. INC. (US) 1995-07-12 EP disclosed