SCHEMBL5423152

SCHEMBL5423152

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C(C)(C)OC(=O)CCCCCCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.49
DGKA P23743 1/20 0.47
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 1/20 0.44
PAM P19021 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
FFAR1 O14842 1/20 0.43
KDM4E B2RXH2 1/20 0.42
DUSP3 P51452 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
FDPS P14324 1/20 0.42
TSHR P16473 1/20 0.41
CES2 O00748 3/20 0.41
CES1 P23141 3/20 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
SCHEMBL27561449 0.86 LMNA (0.47) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL29227003 0.85 LMNA (0.51) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL17201393 0.85 MAPT (0.47) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL31020846 0.82 FFAR4 (0.49) MAPTALDH1A1PAMFFAR4FFAR1
SCHEMBL28233784 0.82 LMNA (0.55) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL19065763 0.81 LMNA (0.51) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL27722265 0.81 LMNA (0.50) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL28986369 0.80 LMNA (0.46) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL11764112 0.79 LMNA (0.49) LMNADGKAMAPTMAPK1ALDH1A1
SCHEMBL29373377 0.79 LMNA (0.53) LMNADGKAMAPTMAPK1ALDH1A1

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-20070010700-A1 Safety containers for biologically active substances and method for producing said container BAXTER INTERNATIONAL INC (US) 2007-01-11 US disclosed