SCHEMBL17812657

SCHEMBL17812657

CC(C)CCCCCCCCCCCCOC(=O)CC(=O)OCCCCCCCCCCCCC(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.46
NAAA Q02083 1/20 0.45
RARB P10826 1/20 0.42
KDM4C Q9H3R0 2/20 0.40
KDM4A O75164 1/20 0.40
PHF8 Q9UPP1 1/20 0.40
KDM2A Q9Y2K7 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
RAD52 P43351 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
EPHX1 P07099 1/20 0.38
CYP19A1 P11511 1/20 0.38
TSHR P16473 2/20 0.37
ACHE P22303 2/20 0.37

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
SCHEMBL26108339 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812516 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL28318395 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812763 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812587 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812498 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812623 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812791 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL17812624 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A
SCHEMBL3222809 1.00 FAAH (0.46) FAAHNAAARARBKDM4CKDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9365715-B2 Thermoplastic elastomer composition and method for the production thereof STYROLUTION EUROPE GMBH (DE) 2016-06-14 US disclosed