SCHEMBL28869403

SCHEMBL28869403

CC(C)(C)COC(=O)CCCCO

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGKA P23743 1/20 0.41
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
GPR84 Q9NQS5 1/20 0.38
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
PAM P19021 2/20 0.37
KDM4E B2RXH2 2/20 0.37
DUSP3 P51452 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 1/20 0.36
VCAM1 P19320 1/20 0.36
TSHR P16473 1/20 0.35
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCE Q02156 1/20 0.35

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
SCHEMBL13597953 0.98 DGKA (0.44) DGKACYP4F2CYP4A11GPR84FFAR1
SCHEMBL2537190 0.94 DGKA (0.38) DGKACYP4F2CYP4A11PAMKDM4E
SCHEMBL28388700 0.93 DGKA (0.44) DGKACYP4F2CYP4A11
SCHEMBL852013 0.91 DGKA (0.46) DGKAPAMKDM4EDUSP3MEN1
1,6-Hexanediol SCHEMBL4650951 0.91 GPR84 (0.55) GPR84FFAR1FFAR4PAMMEN1
1,4-Butanediol SCHEMBL8898729 0.91 GPR84 (0.50) GPR84FFAR1FFAR4PAMMEN1
SCHEMBL1473314 0.91 DGKA (0.47) DGKACYP4F2CYP4A11
1,6-Hexanediol SCHEMBL2487660 0.89 GPR84 (0.53) GPR84FFAR1FFAR4PAMMEN1
SCHEMBL7680017 0.89 DGKA (0.50) DGKAPAMKDM4EDUSP3MEN1
SCHEMBL7047236 0.89 DGKA (0.50) DGKAPAMKDM4EDUSP3MEN1

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
CN-109233255-A A kind of stable high abrasion compound polyurethane material and preparation method thereof 宁波雅致机械有限公司 2019-01-18 CN disclosed