SCHEMBL27157441

SCHEMBL27157441

O=C(O)CCCCOCOCCNCCOCOCCCCC(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.44
TSHR P16473 4/20 0.42
NFKB1 P19838 2/20 0.42
PMP22 Q01453 1/20 0.42
PRMT1 Q99873 1/20 0.41
SLC22A6 Q4U2R8 2/20 0.39
ADRA1A P35348 1/20 0.38
GPR84 Q9NQS5 3/20 0.37
FFAR1 O14842 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37
AKR1B1 P15121 1/20 0.37
CYP2D6 P10635 1/20 0.37
FOLH1 Q04609 1/20 0.37
LTA4H P09960 1/20 0.36
PPARG P37231 2/20 0.35
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
SLC22A8 Q8TCC7 1/20 0.35
TLR2 O60603 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
SCHEMBL27204212 0.90 TSHR (0.39) ALDH1A1LMNATSHRNFKB1PMP22
SCHEMBL7720909 0.84 ALDH1A1 (0.45) ALDH1A1LMNATSHRNFKB1PMP22
SCHEMBL21753088 0.82 ALDH1A1 (0.48) ALDH1A1TSHRSLC22A6GPR84FFAR1
SCHEMBL21753144 0.82 ALDH1A1 (0.48) ALDH1A1TSHRSLC22A6GPR84FFAR1
SCHEMBL22836769 0.80 GPR84 (0.52) ALDH1A1TSHRSLC22A6GPR84FFAR1
SCHEMBL31631394 0.80 PRMT1 (0.50) ALDH1A1LMNATSHRNFKB1PMP22
SCHEMBL22835027 0.79 GPR84 (0.55) ALDH1A1TSHRSLC22A6GPR84FFAR1
SCHEMBL22288109 0.79 GPR84 (0.55) ALDH1A1TSHRSLC22A6GPR84FFAR1
SCHEMBL21611669 0.79 GPR84 (0.55) ALDH1A1TSHRSLC22A6GPR84FFAR1
SCHEMBL23705031 0.78 ALDH1A1 (0.48) ALDH1A1LMNATSHRNFKB1PMP22

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
EP-4332086-A1 COMPOUND OR SALT THEREOF, LIPID PARTICLES, AND PHARMACEUTICAL COMPOSITION FUJIFILM Corporation (JP) 2024-03-06 EP disclosed