SCHEMBL6437780

SCHEMBL6437780

CCCC(O)C(C)OCC(C)O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.34
TSHR P16473 2/20 0.33
MAPT P10636 1/20 0.33
SPHK1 Q9NYA1 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
SCHEMBL1156854 0.92 TDP1 (0.53) TDP1HSD17B10LMNAMAPK1MAPT
SCHEMBL622449 0.87 TDP1 (0.42) TDP1HSD17B10LMNAMAPK1MAPT
SCHEMBL1122050 0.84 SPHK1 (0.52) TDP1LMNAMAPTSPHK1
SCHEMBL4455706 0.82 TDP1 (0.36) TDP1HSD17B10MAPK1
SCHEMBL17898232 0.82 TDP1 (0.36) TDP1HSD17B10MAPK1
SCHEMBL1959442 0.81 TDP1 (0.43) TDP1HSD17B10LMNAMAPK1TSHR
SCHEMBL620027 0.81 TDP1 (0.50) TDP1HSD17B10LMNAMAPTSPHK1
SCHEMBL9493036 0.79 SPHK1 (0.39) TDP1HSD17B10LMNAMAPTSPHK1
SCHEMBL27582744 0.79 HSD17B10 (0.39) TDP1HSD17B10LMNATSHRSPHK1
SCHEMBL4142740 0.78 TDP1 (0.34) TDP1HSD17B10MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4552718-A1 ANTIFOAMING AGENT COMPOSITION, AQUEOUS COATING COMPOSITION AND ARTICLE Kusumoto Chemicals, Ltd. (JP) 2025-05-14 EP disclosed
EP-1023837-B1 Non-aqueous, emulsifiable concentrate formulation BASF AG (DE) 2005-03-30 EP disclosed
US-6872736-B1 Non-aqueous emulsifiable concentrate formulation BASF AKTIENGESELLSCHAFT (DE) 2005-03-29 US disclosed
EP-1023837-A2 Non-aqueous, emulsifiable concentrate formulation American Cyanamid Company (US) 2000-08-02 EP disclosed
US-4612058-A Compositions for removing polymeric films HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1986-09-16 US disclosed