SCHEMBL7906767

SCHEMBL7906767

CCCCCCCCCCCCCCCCCCCCCCOC(=O)N(C)C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.40
EPHX1 P07099 1/20 0.38
TSHR P16473 2/20 0.37
USP2 O75604 1/20 0.37
SPHK1 Q9NYA1 1/20 0.37
KDM4E B2RXH2 1/20 0.37
DUSP3 P51452 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
RAD52 P43351 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL7906758 1.00 NAAA (0.40) NAAAEPHX1TSHRUSP2SPHK1
SCHEMBL8798951 1.00 NAAA (0.40) NAAAEPHX1TSHRUSP2SPHK1
SCHEMBL5187222 1.00 NAAA (0.40) NAAAEPHX1TSHRUSP2SPHK1
SCHEMBL7906801 1.00 NAAA (0.40) NAAAEPHX1TSHRUSP2SPHK1
SCHEMBL1008681 1.00 NAAA (0.40) NAAAEPHX1TSHRUSP2SPHK1
SCHEMBL7553699 1.00 NAAA (0.40) NAAAEPHX1TSHRUSP2SPHK1
SCHEMBL8441647 0.92 ACE2 (0.38) NAAAEPHX1SPHK1KDM4EMEN1
SCHEMBL6141279 0.92 ACE2 (0.38) NAAAEPHX1SPHK1KDM4EMEN1
SCHEMBL5720257 0.90 ACE2 (0.35) NAAAEPHX1SPHK1KDM4EMEN1
SCHEMBL5720416 0.85 CHRNB2 (0.35)

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
EP-0648204-B1 AMINO DEOXYALDITOL LIPOPHILIC DERIVATIVES FOR USE IN COSMETICS, COSMETIC COMPOSITIONS CONTAINING SAME AND NOVEL ALKYL CARBAMATES OREAL (FR) 1998-11-18 EP claimed
US-5616746-A SKIN AND HAIR TREATMENT L'OREAL 1997-04-01 US claimed
EP-0648204-A1 AMINO DEOXYALDITOL LIPOPHILIC DERIVATIVES FOR USE IN COSMETICS, COSMETIC COMPOSITIONS CONTAINING SAME AND NOVEL ALKYL CARBAMATES L'OREAL (FR) 1995-04-19 EP claimed
WO-1994024097-A1 AMINO DEOXYALDITOL LIPOPHILIC DERIVATIVES FOR USE IN COSMETICS, COSMETIC COMPOSITIONS CONTAINING SAME AND NOVEL ALKYL CARBAMATES L'OREAL (FR) 1994-10-27 WO claimed
US-6210691-B1 LIPOPHILIC DERIVATIVES OF AMINO DEOXYALDITOLS, SHAMPOOS AND HAIR CONDITIONERS L'OREAL (FR) 2001-04-03 US disclosed
US-6001376-A COSMETIC COMPOSITIONS FOR THE TREATMENT OF KERATINOUS SUBSTANCES AND FOR BUCCODENTAL HYGIENE L'OREAL (FR) 1999-12-14 US disclosed
EP-0648204-B1 AMINO DEOXYALDITOL LIPOPHILIC DERIVATIVES FOR USE IN COSMETICS, COSMETIC COMPOSITIONS CONTAINING SAME AND NOVEL ALKYL CARBAMATES OREAL (FR) 1998-11-18 EP disclosed
US-5616746-A SKIN AND HAIR TREATMENT L'OREAL 1997-04-01 US disclosed