SCHEMBL25666396

SCHEMBL25666396

C=C(C)C(=O)OCCNC(=O)OCC1(C)CCCCC(O)C1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
EPHX1 P07099 1/20 0.31
THRB P10828 1/20 0.31
TSHR P16473 2/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
ATM Q13315 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
SCHEMBL21115953 0.78 MEN1 (0.34) MEN1KMT2AL3MBTL1ALDH1A1MAPT
SCHEMBL16937483 0.73 THRB (0.38) THRBTSHRALDH1A1
SCHEMBL16937490 0.73 THRB (0.34) MEN1KMT2AEPHX1THRBTSHR
SCHEMBL16937493 0.72 EPHX1 (0.36) MEN1KMT2AL3MBTL1EPHX1THRB
SCHEMBL16937526 0.72 EPHX1 (0.36) MEN1KMT2AL3MBTL1EPHX1THRB
SCHEMBL16937527 0.72 EPHX1 (0.36) MEN1KMT2AL3MBTL1EPHX1THRB
SCHEMBL21115847 0.72 MEN1 (0.33) MEN1KMT2AL3MBTL1TSHR
SCHEMBL14409133 0.71 MEN1 (0.36) MEN1KMT2AL3MBTL1THRBTSHR
SCHEMBL10083136 0.71 MEN1 (0.32) MEN1KMT2AL3MBTL1
SCHEMBL21115827 0.71 TSHR (0.34) MEN1KMT2AL3MBTL1TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230212357-A1 WOUND DRESSINGS COMPRISING POLYSILOXANE-POLYGLYCEROL BLOCK COPOLYMERS AND METHODS OF MAKING AND USE THEREOF CLEARLAB SG PTE LTD (SG) 2023-07-06 US disclosed
US-11649325-B2 Actinically-crosslinkable polysiloxane-polyglycerol block copolymers and methods of making and use thereof Clearlab Sg Pte Ltd. (SG) 2023-05-16 US disclosed