SCHEMBL6161694

SCHEMBL6161694

CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CCc2ccc(S(N)(=O)=O)cc2C1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
TACR1 P25103 2/20 0.44
CTSL P07711 4/20 0.44
CTSS P25774 1/20 0.44
CTSK P43235 1/20 0.44
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ACE P12821 2/20 0.43
TP53 P04637 1/20 0.42
PKM P14618 1/20 0.42
UGCG Q16739 2/20 0.41
CYP3A4 P08684 1/20 0.41

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
SCHEMBL6163734 0.91 TACR1 (0.48) MEN1KMT2ATACR1CTSLCTSS
SCHEMBL6163736 0.91 TACR1 (0.48) MEN1KMT2ATACR1CTSLCTSS
SCHEMBL6164567 0.90 ALDH1A1 (0.46) MEN1KMT2ATACR1CTSLCTSS
SCHEMBL8412738 0.90 ALDH1A1 (0.46) MEN1KMT2ATACR1CTSLCTSS
SCHEMBL6160909 0.90 CTSL (0.50) MEN1KMT2ATACR1CTSLCTSS
SCHEMBL6165094 0.89 GHSR (0.49) KMT2AACEPKMUGCGCYP3A4
SCHEMBL6165098 0.89 GHSR (0.49) KMT2AACEPKMUGCGCYP3A4
SCHEMBL6166126 0.89 TACR1 (0.46) MEN1KMT2ATACR1CTSLCTSS
Hydrochloric Acid SCHEMBL6162564 0.88 GHSR (0.49) KMT2AACEPKMUGCGCYP3A4
Hydrochloric Acid SCHEMBL6162898 0.88 GHSR (0.49) KMT2AACEPKMUGCGCYP3A4

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
EP-0828754-B1 DIPEPTIDES WHICH PROMOTE RELEASE OF GROWTH HORMONE PFIZER (US) 2005-02-02 EP disclosed