SCHEMBL31280652

SCHEMBL31280652

CC(CCCCI)(C(=O)O)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.39
CPT2 P23786 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ACLY P53396 1/20 0.39
ACACB O00763 1/20 0.38
ACACA Q13085 1/20 0.38
ARG1 P05089 2/20 0.36
ARG2 P78540 2/20 0.36
TSHR P16473 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
AMPD3 Q01432 1/20 0.31
GGT1 P19440 1/20 0.31
NAALAD2 Q9Y3Q0 1/20 0.30

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
SCHEMBL31280480 0.98 FFAR1 (0.43) FFAR1CPT2TDP1ACLYACACB
SCHEMBL31279948 0.98 FFAR1 (0.43) FFAR1CPT2TDP1ACLYACACB
SCHEMBL5474459 0.84 ALDH1A1 (0.42) FFAR1CPT2TDP1ACLYACACB
SCHEMBL5795040 0.83 ACLY (0.57) FFAR1CPT2TDP1ACLYACACB
SCHEMBL7161723 0.81 ACLY (0.61) FFAR1CPT2TDP1ACLYACACB
SCHEMBL27754242 0.81 ACLY (0.61) FFAR1CPT2TDP1ACLYACACB
SCHEMBL4035472 0.81 ACLY (0.61) FFAR1CPT2TDP1ACLYACACB
SCHEMBL31280022 0.80 CYP4F2 (0.44) FFAR1CPT2TDP1ACLYACACB
SCHEMBL2241779 0.80 GGPS1 (0.46) FFAR1TDP1TSHRALDH1A1
SCHEMBL19086450 0.79 FFAR1 (0.40) FFAR1CPT2TDP1ACLYACACB

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-119173498-A Lipid and lipid-containing nanoparticle and uses thereof 周美吟 2024-12-20 CN disclosed