SCHEMBL7029602

SCHEMBL7029602

CCCCCC=CCC=CCC=CCC=CCCCC(=O)OCC(C)C

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.74
MGLL Q99685 1/20 0.68
CNR1 P21554 4/20 0.67
ALDH1A1 P00352 3/20 0.67
MAPT P10636 3/20 0.67
THRB P10828 1/20 0.67
HPGD P15428 2/20 0.62
CNR2 P34972 1/20 0.62
DGKA P23743 1/20 0.61
PPARG P37231 2/20 0.58
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
USP2 O75604 1/20 0.58
LMNA P02545 1/20 0.58
TP53 P04637 1/20 0.58
CYP3A4 P08684 1/20 0.58
HSPD1 P10809 1/20 0.58
CYP19A1 P11511 1/20 0.58
FABP4 P15090 1/20 0.58
ALOX15 P16050 1/20 0.58

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
SCHEMBL7029598 1.00 FAAH (0.74) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL12116640 0.95 FAAH (0.68) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL82050 0.95 FAAH (0.68) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL6895087 0.95 FAAH (0.67) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL12116641 0.95 FAAH (0.67) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL8706465 0.91 FAAH (0.67) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL8706471 0.91 FAAH (0.67) FAAHMGLLCNR1ALDH1A1MAPT
SCHEMBL3658169 0.90 DGKA (0.73) FAAHMAPTDGKARECQLBLM
SCHEMBL332985 0.90 DGKA (0.73) FAAHMAPTDGKARECQLBLM
SCHEMBL9169298 0.90 DGKA (0.73) FAAHMAPTDGKARECQLBLM

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-20030054103-A1 Curable coating composition, curable ink, printing method thereof and printed matter TOYO INK MFG. CO., LTD. (JP) 2003-03-20 US disclosed