SCHEMBL85848

SCHEMBL85848

CC(C)C(=O)OCCNC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPC1 O15118 1/20 0.33
CHRNB2 P17787 2/20 0.33
CHRNB4 P30926 2/20 0.33
CHRNA3 P32297 2/20 0.33
CHRNA4 P43681 2/20 0.33
ACHE P22303 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31

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
SCHEMBL12385783 0.84 ALDH1A1 (0.43) MEN1KMT2ANPC1CHRNB2CHRNB4
SCHEMBL14493157 0.83 KMT2A (0.48) CYP2D6CYP2C19MEN1KMT2ANPC1
SCHEMBL12523122 0.83 MAPK1 (0.44) MEN1KMT2ASMN1; SMN2L3MBTL1HPGD
SCHEMBL15499961 0.82 CYP2D6 (0.39) CYP2D6CYP2C19MEN1KMT2ACHRNB2
SCHEMBL25665600 0.81 EPHX1 (0.44) MEN1KMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL21391467 0.79 MEN1 (0.50) MEN1KMT2A
SCHEMBL2608182 0.78 ZDHHC20 (0.47) MEN1KMT2AHPGD
SCHEMBL22742401 0.78 EPHX1 (0.47) MEN1KMT2ACHRNB2CHRNB4CHRNA3
SCHEMBL17010894 0.78 POLB (0.38) CYP2C19MEN1KMT2ANPC1SMN1; SMN2
SCHEMBL14679295 0.78 CYP2D6 (0.43) CYP2D6CYP2C19MEN1KMT2AL3MBTL1

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
WO-2020165600-A1 BICYCLIC PEPTIDE LIGAND STING CONJUGATES AND USES THEREOF BICYCLETX LIMITED (GB) 2020-08-20 WO disclosed
US-8128393-B2 Methods and materials for fabricating laminate nanomolds and nanoparticles therefrom LIQUIDIA TECHNOLOGIES, INC. (US) 2012-03-06 US disclosed
US-20080131692-A1 Methods and materials for fabricating laminate nanomolds and nanoparticles therefrom LIQUIDIA TECHNOLOGIES, INC. 2008-06-05 US disclosed