SCHEMBL25828199

SCHEMBL25828199

CC(C)(C(=O)c1ccc(CC(C(=O)N(CCO)CCO)C(=O)N(CCO)CCO)cc1)N1CCOCC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
TSHR P16473 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MAPK1 P28482 1/20 0.50
HRH3 Q9Y5N1 3/20 0.40
MMP8 P22894 1/20 0.34
ACACB O00763 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GSK3B P49841 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL4562714 0.80 ALDH1A1 (0.55) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL25828196 0.80 MLYCD (0.33) THRATHRB
SCHEMBL306032 0.78 ALDH1A1 (0.65) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL9680431 0.77 ALDH1A1 (0.58) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL307240 0.74 ALDH1A1 (0.63) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL725770 0.73 ALDH1A1 (0.59) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL3670808 0.73 ALDH1A1 (0.62) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL8070009 0.73 ALDH1A1 (0.62) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL2918327 0.72 ALDH1A1 (0.60) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL3677741 0.72 ALDH1A1 (0.60) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023180075-A1 POLYMERIZABLE PHOTOINITIATORS ARKEMA FRANCE (FR) 2023-09-28 WO disclosed
EP-4249518-A1 POLYMERIZABLE PHOTOINITIATORS ARKEMA FRANCE (FR) 2023-09-27 EP disclosed
WO-2023126223-A1 POLYHYDROXYLATED PHOTOINITIATORS ARKEMA FRANCE (FR) 2023-07-06 WO disclosed
EP-4206183-A1 POLYHYDROXYLATED PHOTOINITIATORS ARKEMA FRANCE (FR) 2023-07-05 EP disclosed