SCHEMBL28959802

SCHEMBL28959802

O=C(O)CCCCOC(=O)CCCCO

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.60
FFAR1 O14842 1/20 0.60
FFAR4 Q5NUL3 1/20 0.60
CAMK2A Q9UQM7 1/20 0.52
ALDH1A1 P00352 1/20 0.47
NPC1 O15118 1/20 0.46
LMNA P02545 2/20 0.46
DGKA P23743 1/20 0.45
TSHR P16473 2/20 0.44
NFKB1 P19838 1/20 0.44
PMP22 Q01453 1/20 0.44
PAM P19021 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.40
PRSS1 P07477 1/20 0.40
PRSS2 P07478 1/20 0.40
PRSS3 P35030 1/20 0.40
GAA P10253 1/20 0.39
PPARA Q07869 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38

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
SCHEMBL19912238 1.00 GPR84 (0.60) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL208716 1.00 GPR84 (0.60) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL6397493 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL3505305 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL8737410 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL7606824 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL18710354 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL7033618 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL7064050 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1
SCHEMBL12922833 0.98 GPR84 (0.64) GPR84FFAR1FFAR4CAMK2AALDH1A1

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-111511434-A Oral delivery of active drug substances 柏欧格瑞有限责任公司 2020-08-07 CN disclosed