SCHEMBL6061189

SCHEMBL6061189

CCCC(=O)CC1(C(=O)OCC)CCCC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 3/20 0.34
KDM4E B2RXH2 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 4/20 0.33
KMT2A Q03164 4/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
GAA P10253 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL28043400 0.84 CYP2C19 (0.37) SMN1; SMN2POLBKDM4EL3MBTL1MEN1
SCHEMBL29168787 0.84 CYP4F2 (0.47) MEN1KMT2ACYP4F2CYP4A11MAPT
SCHEMBL6581875 0.80 CYP2C19 (0.53) SMN1; SMN2POLBKDM4EL3MBTL1MEN1
SCHEMBL28636627 0.79 CYP2C19 (0.57) SMN1; SMN2POLBKDM4EL3MBTL1MEN1
SCHEMBL17454 0.77 SMN1; SMN2 (0.40) SMN1; SMN2POLBKDM4EMEN1KMT2A
SCHEMBL7487765 0.77 CYP2C19 (0.48) SMN1; SMN2POLBKDM4EMEN1KMT2A
SCHEMBL1142569 0.76 SMN1; SMN2 (0.39) SMN1; SMN2POLBKDM4EMEN1KMT2A
SCHEMBL1691141 0.76 CYP4F2 (0.41) SMN1; SMN2POLBKDM4EMEN1KMT2A
SCHEMBL11345271 0.75 CYP4F2 (0.49) POLBL3MBTL1MEN1KMT2ACYP4F2
SCHEMBL2079 0.74 CYP1A2 (0.39) SMN1; SMN2POLBKDM4EMEN1KMT2A

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
WO-2006045246-A1 CYCLOPENTANE CARBOXYLATE COMPOUNDS, PROCESS AND INTERMEDIATES FOR PREPARING THE SAME AND USE THEREOF CHINA PETROLEUM & CHEMICAL CORPORATION (CN) 2006-05-04 WO disclosed