SCHEMBL25828107

SCHEMBL25828107

O=C(COc1cc(OCC(=O)N(CCO)CCO)c2sc3ccccc3c(=O)c2c1)N(CCO)CCO

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
PDK2 Q15119 1/20 0.40
ALDH1A1 P00352 3/20 0.39
LMNA P02545 2/20 0.39
MAPT P10636 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HCRTR1 O43613 1/20 0.39
HPGD P15428 2/20 0.39
CSF1R P07333 1/20 0.39
KDM4E B2RXH2 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
TSHR P16473 2/20 0.36
MAOA P21397 7/20 0.36
MAOB P27338 7/20 0.36
PTPN2 P17706 1/20 0.35
PTPN1 P18031 1/20 0.35

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
SCHEMBL2385517 0.85 KDM4E (0.52) POLBPDK2ALDH1A1LMNAMAPT
SCHEMBL28997534 0.84 PTPN1 (0.50) POLBALDH1A1LMNAMAPTL3MBTL1
SCHEMBL25828113 0.79 ALDH1A1 (0.39) POLBPDK2ALDH1A1LMNAMAPT
SCHEMBL25828186 0.79 RAD52 (0.37) POLBPDK2ALDH1A1LMNAMAPT
SCHEMBL29771150 0.78 MAPT (0.49) POLBALDH1A1LMNAMAPTL3MBTL1
SCHEMBL131320 0.78 MAPT (0.49) POLBALDH1A1LMNAMAPTL3MBTL1
SCHEMBL4537591 0.77 POLB (0.38) POLBPDK2ALDH1A1LMNAMAPT
SCHEMBL25828115 0.77 POLB (0.37) POLBPDK2ALDH1A1LMNAMAPT
SCHEMBL13066288 0.76 ALDH1A1 (0.52) POLBALDH1A1LMNAMAPTL3MBTL1
SCHEMBL22722495 0.72 ALDH1A1 (0.53) POLBALDH1A1LMNAMAPTL3MBTL1

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