SCHEMBL6842488

SCHEMBL6842488

CCC(OC)C(CO)NCCO

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.35
CNR1 P21554 1/20 0.35
ADRA1A P35348 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ABCC3 O15438 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
Methacrylic Acid SCHEMBL14994191 0.86 TGFBR1 (0.32)
SCHEMBL6842509 0.85 TSHR (0.31) KDM4E
SCHEMBL8141414 0.82 LMNA (0.35) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL24218293 0.78 KDM4E (0.33) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL6846788 0.75
SCHEMBL7775574 0.74 ALDH1A1 (0.39) CNR1KDM4E
SCHEMBL9819665 0.72 LMNA (0.39) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL730154 0.72 LMNA (0.39) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL352466 0.71 LMNA (0.38) LMNACNR1ADRA1ATDP1KDM4E
SCHEMBL2924806 0.69 TRPV3 (0.34) LMNACNR1ADRA1ATDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6787592-B1 OLEOPHILIC NANOCOMPOSITES SOUTHERN CLAY PRODUCTS, INC. 2004-09-07 US claimed
US-6037315-A QUATERNARY AMMONIUM SALT COMPRISING MIXTURE OF MONO-, DI- AND TRI-ESTER COMPONENTS; USED AS A FABRIC SOFTENER AND AS A HAIR AND SKIN CONDITIONER AKZO NOBEL NV (NL) 2000-03-14 US claimed
US-6787592-B1 OLEOPHILIC NANOCOMPOSITES SOUTHERN CLAY PRODUCTS, INC. 2004-09-07 US disclosed
US-6770608-B2 TEXTILE SOFTENING; HAIR AND SKIN CONDITIONER AKZO NOBEL N.V. (NL) 2004-08-03 US disclosed
US-20020025915-A1 High Di(alkyl fatty ester) amines and quaternary ammonium compounds derived therefrom AKZO NOBEL N.V. (NL) 2002-02-28 US disclosed
US-6323167-B1 COMPOSITIONS WHICH COMPRISE QUATERNARY AMMONIUM BASED SOFTENING AGENTS WHICH ARE HIGH IN DIESTER AND LOW IN TRIESTER CONTENT AKZO NOBEL N.V. (NL) 2001-11-27 US disclosed
WO-2001028924-A1 ORGANOCLAY COMPOSITIONS PREPARED FROM ESTER QUATS AND COMPOSITES BASED ON THE COMPOSITIONS SOUTHERN CLAY PRODUCTS, INC. (US) 2001-04-26 WO disclosed
US-6037315-A QUATERNARY AMMONIUM SALT COMPRISING MIXTURE OF MONO-, DI- AND TRI-ESTER COMPONENTS; USED AS A FABRIC SOFTENER AND AS A HAIR AND SKIN CONDITIONER AKZO NOBEL NV (NL) 2000-03-14 US disclosed