SCHEMBL28843552

SCHEMBL28843552

CCOC(=O)C(C)(C)CCCCCC=O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.67
CYP4A11 Q02928 2/20 0.67
MAPT P10636 2/20 0.45
ACLY P53396 1/20 0.44
HTT P42858 1/20 0.44
PKM P14618 2/20 0.41
THRB P10828 1/20 0.41
TSHR P16473 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
FAAH O00519 2/20 0.37
TRPV1 Q8NER1 1/20 0.37
PRKCA P17252 4/20 0.36
GAA P10253 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
SCHEMBL4096371 0.95 CYP4F2 (0.62) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL20713255 0.88 CYP4F2 (0.69) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL20613555 0.88 CYP4F2 (0.69) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL20713329 0.88 CYP4F2 (0.69) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL31108907 0.88 CYP4F2 (0.69) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL31108848 0.88 CYP4F2 (0.69) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL6257314 0.87 CYP4F2 (0.85) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL6254544 0.87 CYP4F2 (0.85) CYP4F2CYP4A11MAPTACLYHTT
SCHEMBL11070452 0.85 CYP4F2 (0.55) CYP4F2CYP4A11MAPTHTTPKM
SCHEMBL2215598 0.85 CYP4F2 (0.65) CYP4F2CYP4A11MAPTACLYHTT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022199378-A1 SYNTHETIC METHOD OF BEMPEDOIC ACID ACTIVE PHARMACEUTICAL INGREDIENT 上海鼎雅药物化学科技有限公司 2022-09-29 WO disclosed
CN-115108904-A Synthesis method of betimeric acid bulk drug 上海鼎雅药物化学科技有限公司 2022-09-27 CN disclosed