SCHEMBL8756038

SCHEMBL8756038

CCCCCCCCCCCCCCOC(=O)CC[C@@H](O)CCCCCC

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.57
NAAA Q02083 1/20 0.56
DGKA P23743 1/20 0.56
FFAR4 Q5NUL3 1/20 0.56
FFAR1 O14842 1/20 0.56
HTR2C P28335 1/20 0.54
KDM4E B2RXH2 1/20 0.50
DUSP3 P51452 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
NFKB1 P19838 1/20 0.50
LMNA P02545 1/20 0.50
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
MAPT P10636 1/20 0.49
RAD52 P43351 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL28073549 1.00 GPR84 (0.57) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL27501113 0.97 GPR84 (0.57) GPR84NAAADGKAFFAR4FFAR1
Methane SCHEMBL27958443 0.95 GPR84 (0.56) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL7705389 0.95 DGKA (0.63) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL8329472 0.93 DGKA (0.67) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL3831865 0.93 DGKA (0.67) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL3487747 0.93 DGKA (0.67) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL3487884 0.93 DGKA (0.67) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL3487063 0.93 DGKA (0.67) GPR84NAAADGKAFFAR4FFAR1
SCHEMBL3487129 0.93 DGKA (0.67) GPR84NAAADGKAFFAR4FFAR1

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-0687735-B1 Method for enzymatic transesterification SUEDDEUTSCHE KALKSTICKSTOFF (DE) 1997-05-07 EP disclosed
EP-0687735-A1 Method for enzymatic transesterification SKW Trostberg Aktiengesellschaft (DE) 1995-12-20 EP disclosed