Sugi Predict

Sugi Predict / Compounds / SCHEMBL8924022

SCHEMBL8924022

SCHEMBL8924022

CC(CCN(CCCCNC(=O)C(OCc1ccccc1)C(=O)NCCCCCCN/C(=N/C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)Cc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.38
▸ SIRT2 Q8IXJ6 2/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ SIRT1 Q96EB6 1/20 0.37
▸ SIRT3 Q9NTG7 1/20 0.37
▸ APP P05067 1/20 0.36
▸ MEN1 O00255 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ CTSS P25774 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
SCHEMBL8920924 1.00 MAPT (0.38) MAPTSIRT2L3MBTL1SIRT1SIRT3
SCHEMBL8920908 1.00 MAPT (0.38) MAPTSIRT2L3MBTL1SIRT1SIRT3
SCHEMBL8924035 1.00 MAPT (0.38) MAPTSIRT2L3MBTL1SIRT1SIRT3
SCHEMBL8919864 0.93 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1
SCHEMBL8924021 0.93 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1
SCHEMBL8924038 0.93 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1
SCHEMBL8919876 0.93 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1
SCHEMBL8921779 0.90 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1
SCHEMBL8921767 0.90 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1
SCHEMBL8923113 0.90 APP (0.37) MAPTSIRT2L3MBTL1APPMEN1

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-5637613-A ANTITUMOR AGENT; IMMUNOSUPPRESSANTS FOURNIER INDUSTRIE ET SANTE (FR) 1997-06-10 — — US disclosed