SCHEMBL8375565

SCHEMBL8375565

COC(=O)CCCCCN(C)CCO

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
KDM5A P29375 6/20 0.56
TSHR P16473 3/20 0.50
LMNA P02545 2/20 0.46
ALDH1A1 P00352 1/20 0.46
DNM1 Q05193 1/20 0.42
LTA4H P09960 1/20 0.42
KDM4C Q9H3R0 6/20 0.41
PHF8 Q9UPP1 2/20 0.41
KDM4A O75164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL8374162 0.92 MEN1 (0.61) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL18499076 0.92 KMT2A (0.65) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL16644494 0.92 KDM5A (0.50) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL2806191 0.87 MEN1 (0.59) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL5306517 0.85 KDM5A (0.74) KMT2AMEN1KDM5ATSHRDNM1
SCHEMBL26629541 0.84 MEN1 (0.79) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL8374457 0.84 KMT2A (0.79) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL14430424 0.84 MEN1 (0.71) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL25121067 0.84 KDM5A (0.55) KMT2AMEN1KDM5ATSHRLMNA
SCHEMBL17214377 0.84 DNM1 (0.53) KDM5ADNM1LTA4HKDM4CPHF8

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
EP-0643128-B1 Aqueous fabric softener composition, novel quaternary ammonium salt, and process for the preparation of said salt KAO CORP (JP) 1999-03-10 EP disclosed
US-5580481-A Aqueous fabric softener composition, novel quaternary ammonium salt, and process for the preparation of said salt KAO CORPORATION (JP) 1996-12-03 US disclosed
US-5476597-A Storage stability, elasticity KAO CORPORATION (JP) 1995-12-19 US disclosed
EP-0643128-A1 Aqueous fabric softener composition, novel quaternary ammonium salt, and process for the preparation of said salt Kao Corporation (JP) 1995-03-15 EP disclosed