SCHEMBL5644653

SCHEMBL5644653

CCC(C)C1(C(=O)O)CCCCC1(C(=O)O)C(C)CC

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.34
MME P08473 1/20 0.33
FFAR3 O14843 1/20 0.32
PPARA Q07869 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TSHR P16473 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
SCHEMBL5647881 0.85 MAPT (0.42)
SCHEMBL3764009 0.79 MAPT (0.43) MEN1KMT2A
SCHEMBL5644947 0.79 CYP3A4 (0.33) MEN1KMT2ATSHR
SCHEMBL5644983 0.78 CETP (0.33) MEN1KMT2A
SCHEMBL5643429 0.78 CETP (0.33) MEN1KMT2A
SCHEMBL5644429 0.78 CETP (0.33) MEN1KMT2A
SCHEMBL5646418 0.78 CETP (0.33) MEN1KMT2A
SCHEMBL5642558 0.78 CETP (0.33) MEN1KMT2A
SCHEMBL5647304 0.78 CETP (0.33) MEN1KMT2A
SCHEMBL5644323 0.78 CETP (0.33) MEN1KMT2A

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
US-7271282-B1 Dicarboxylic diester, process for producing the same, and refrigerating machine lubricating oil comprising the ester NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-09-18 US disclosed