SCHEMBL8312098

SCHEMBL8312098

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC2(CC1)CC(C(=O)NS(C)(=O)=O)c1ccccc12

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC1 Q13547 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CTSL P07711 3/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
UGCG Q16739 2/20 0.40
CYP3A4 P08684 1/20 0.40
PKM P14618 1/20 0.40
TACR1 P25103 2/20 0.40
MCL1 Q07820 1/20 0.39
TACR2 P21452 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL8312093 1.00 MEN1 (0.46) MEN1KMT2AHDAC1HDAC8CTSL
SCHEMBL8311537 0.87 MEN1 (0.48) MEN1KMT2AHDAC1HDAC8CTSL
SCHEMBL8311541 0.87 MEN1 (0.48) MEN1KMT2AHDAC1HDAC8CTSL
Trifluoroacetic Acid SCHEMBL8522196 0.86 TACR2 (0.42) MEN1KMT2AUGCGCYP3A4TACR1
Trifluoroacetic Acid SCHEMBL8522197 0.86 TACR2 (0.42) MEN1KMT2AUGCGCYP3A4TACR1
SCHEMBL8311927 0.85 MEN1 (0.46) MEN1KMT2ACTSLCTSSCTSK
SCHEMBL8311930 0.85 MEN1 (0.46) MEN1KMT2ACTSLCTSSCTSK
SCHEMBL8311887 0.84 MEN1 (0.47) MEN1KMT2ACTSLCTSSCTSK
SCHEMBL8311885 0.84 MEN1 (0.47) MEN1KMT2ACTSLCTSSCTSK
SCHEMBL8313873 0.84 MEN1 (0.43) MEN1KMT2AHDAC1HDAC8CTSL

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