SCHEMBL4347128

SCHEMBL4347128

CCCCCCCCOC(=O)C(C)C.CCCCCCCCOC(=O)C(C)C

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.59
EPHX1 P07099 1/20 0.55
TSHR P16473 3/20 0.53
HCAR2 Q8TDS4 1/20 0.50
RAD52 P43351 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 2/20 0.48
FAAH O00519 1/20 0.48
LMNA P02545 1/20 0.48
ACHE P22303 6/20 0.48
DGKA P23743 1/20 0.48

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
SCHEMBL2351893 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL534484 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL5355248 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL13878611 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21448747 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL21448671 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL2354508 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL560715 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL2357674 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52
SCHEMBL277754 1.00 NAAA (0.59) NAAAEPHX1TSHRHCAR2RAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2124743-A1 MEDICATION ADHERENCE MONITORING SYSTEM UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2009-12-02 EP disclosed
WO-2008103924-A2 MEDICATION ADHERENCE MONITORING SYSTEM UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2008-08-28 WO disclosed