SCHEMBL28076156

SCHEMBL28076156

O=C(O)CCCCCCCCC(=O)OC(O)CCCCCCCCCO

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.55
FFAR4 Q5NUL3 2/20 0.55
GPR84 Q9NQS5 1/20 0.55
CAMK2A Q9UQM7 1/20 0.43
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
GSTK1 Q9Y2Q3 2/20 0.41
PTPN1 P18031 1/20 0.41
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL28076073 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84CAMK2ALMNA
SCHEMBL28830391 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84CAMK2ALMNA
SCHEMBL28075980 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84CAMK2ALMNA
SCHEMBL8661641 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84CAMK2ALMNA
SCHEMBL9875093 1.00 FFAR1 (0.55) FFAR1FFAR4GPR84CAMK2ALMNA
Water SCHEMBL28913671 0.98 FFAR1 (0.53) FFAR1FFAR4GPR84CAMK2ALMNA
SCHEMBL9009030 0.95 FFAR1 (0.52) FFAR1FFAR4GPR84CAMK2ALMNA
SCHEMBL7905079 0.93 MAPT (0.43) FFAR1FFAR4GPR84LMNAPTPN1
SCHEMBL8661638 0.93 MAPT (0.43) FFAR1FFAR4GPR84LMNAPTPN1
Sebacic Acid SCHEMBL28902910 0.91 GPR84 (0.52) FFAR1FFAR4GPR84CAMK2ALMNA

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-102681375-B Method for producing toner and toner and preparation method 施乐公司 2016-08-10 CN disclosed