SCHEMBL5074173

SCHEMBL5074173

CCCCCCCCCCCCCCC[CH]S(=O)(=O)CCCCCCCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.48
NPC1 O15118 1/20 0.46
S1PR2 O95136 1/20 0.46
S1PR4 O95977 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
TP53 P04637 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
XBP1 P17861 1/20 0.46
S1PR1 P21453 1/20 0.46
MAPK1 P28482 1/20 0.46
AGTR1 P30556 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TSHR P16473 2/20 0.46

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
SCHEMBL5076175 1.00 FAAH (0.48) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL5379280 0.95 FAAH (0.48) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL7858045 0.95 NPC1 (0.52) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL6528747 0.93 ALDH1A1 (0.48) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL135638 0.90 FAAH (0.41) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL133276 0.90 FAAH (0.41) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL3033922 0.88 ALDH1A1 (0.43) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL5330131 0.87 CA2 (0.45) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL8957643 0.84 FAAH (0.50) FAAHNPC1S1PR2S1PR4ALDH1A1
SCHEMBL5384233 0.84 FAAH (0.50) FAAHNPC1S1PR2S1PR4ALDH1A1

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-1697465-B1 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GEN ELECTRIC (US) 2008-02-13 EP disclosed
EP-1697465-A2 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GENERAL ELECTRIC COMPANY (US) 2006-09-06 EP disclosed
WO-2005061623-A2 POLYMER NANOCOMPOSITES AND METHODS FOR THEIR PREPARATION GENERAL ELECTRIC COMPANY (US) 2005-07-07 WO disclosed
US-20050137310-A1 Polymer nanocomposites and methods for their preparation CITIBANK, N.A., AS COLLATERAL AGENT 2005-06-23 US disclosed