SCHEMBL8533788

SCHEMBL8533788

CCCCC(CC)COC(=O)NCC(O)CO

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.51
TSHR P16473 4/20 0.51
TDP1 Q9NUW8 2/20 0.51
ATM Q13315 1/20 0.51
ALDH1A1 P00352 5/20 0.47
LMNA P02545 3/20 0.47
HSD17B10 Q99714 1/20 0.47
CA2 P00918 2/20 0.46
RECQL P46063 1/20 0.44
HRH4 Q9H3N8 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP14 P50281 1/20 0.42
MAPK1 P28482 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL8530159 0.90 LMNA (0.46) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL6141476 0.89 LMNA (0.47) CYP3A4TSHRTDP1ATMLMNA
Ammonia Solution, Strong SCHEMBL9998720 0.85 TSHR (0.57) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL28598856 0.85 TSHR (0.57) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL23878446 0.85 TSHR (0.57) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL8533291 0.85 CYP3A4 (0.48) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL17793973 0.82 SMN1; SMN2 (0.34) CYP3A4TSHRTDP1ATMLMNA
SCHEMBL28062999 0.82 CYP3A4 (0.60) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL8531563 0.81 CYP3A4 (0.55) CYP3A4TSHRTDP1ATMALDH1A1
SCHEMBL9702525 0.80 CYP3A4 (0.58) CYP3A4TSHRTDP1ATMALDH1A1

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-0705599-B1 Use of N-(hydroxyalkyl)-substituted alkyl carbamates as tensioactive agents in cosmetic composition OREAL (FR) 1996-09-25 EP claimed
EP-0705599-A1 Use of N-(hydroxyalkyl)-substituted alkyl carbamates as tensioactive agents in cosmetic composition L'OREAL (FR) 1996-04-10 EP claimed
US-5849308-A Method of providing surfactant properties to a cosmetic or pharmaceutical composition using alkyl N-(hydroxyalkyl) carbamates L'OREAL (FR) 1998-12-15 US disclosed
EP-0705599-B1 Use of N-(hydroxyalkyl)-substituted alkyl carbamates as tensioactive agents in cosmetic composition OREAL (FR) 1996-09-25 EP disclosed
EP-0705599-A1 Use of N-(hydroxyalkyl)-substituted alkyl carbamates as tensioactive agents in cosmetic composition L'OREAL (FR) 1996-04-10 EP disclosed