SCHEMBL23337472

SCHEMBL23337472

CC(=O)SCCN1C(=O)N(CCSC(C)=O)C2C1N(CCSC(C)=O)C(=O)N2CCSC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
MAPK1 P28482 1/20 0.38
CYP2C19 P33261 1/20 0.38
POLB P06746 1/20 0.36
BLM P54132 1/20 0.36
ATM Q13315 1/20 0.36
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
ACE P12821 3/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
ADRA2C P18825 1/20 0.31
TSHR P16473 1/20 0.30
GBA1 P04062 1/20 0.30

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
SCHEMBL23337461 0.79 L3MBTL1 (0.36) L3MBTL1MAPK1TP53GAA
SCHEMBL23336595 0.75 L3MBTL1 (0.33) L3MBTL1
SCHEMBL23336992 0.72 HDAC3 (0.35) L3MBTL1ATMTP53GAAMAPT
SCHEMBL23336989 0.72 KMT2A (0.40) L3MBTL1MAPK1ATMALDH1A1MAPT
SCHEMBL23336993 0.70 NPSR1 (0.33)
SCHEMBL23336594 0.69 ALDH1A1 (0.54) L3MBTL1TP53GAAALDH1A1MAPT
SCHEMBL23336991 0.68
SCHEMBL23195849 0.68 MGLL (0.46) MAPK1CYP2C19POLBBLMATM
SCHEMBL22551299 0.67 CYP2C19 (0.60) CYP2C19POLBBLMATMALDH1A1
SCHEMBL22700977 0.65 ACE (0.36) CYP2C19POLBBLMATMACE

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
WO-2021085300-A1 COMPOSITION, CURED PRODUCT, METHOD FOR MANUFACTURING CURED PRODUCT AND ADDITIVE 株式会社ADEKA 2021-05-06 WO disclosed