SCHEMBL27533751

SCHEMBL27533751

CCCCCC(O)(C(=O)OCCCCCCCC(C)C)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 3/20 0.45
ALDH1A1 P00352 3/20 0.45
LMNA P02545 3/20 0.45
CYP3A4 P08684 2/20 0.43
TP53 P04637 1/20 0.43
MAPK1 P28482 1/20 0.43
SCN5A Q14524 3/20 0.42
SCN9A Q15858 3/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL29140989 1.00 MEN1 (0.46) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL29140966 0.95 MEN1 (0.46) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL29140992 0.91 TSHR (0.53) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL27554525 0.91 TSHR (0.53) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL27528841 0.86 SCN5A (0.48) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL28549238 0.82 MEN1 (0.46) MEN1GAAKMT2ANPSR1ALDH1A1
SCHEMBL28928552 0.81 TSHR (0.46) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL27533748 0.80 MEN1 (0.41) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL29140988 0.80 TSHR (0.41) MEN1GAAKMT2ANPSR1TSHR
SCHEMBL5244754 0.78 TSHR (0.50) MEN1GAAKMT2ANPSR1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1286959-C Lubricating oil composition CHINA PETROLEUM & CHEMICAL (CN) 2006-11-29 CN claimed
CN-1611589-A Lubricating oil composition CHINA PETROCHEMICAL CO LTD (CN) 2005-05-04 CN claimed
CN-1286959-C Lubricating oil composition CHINA PETROLEUM & CHEMICAL (CN) 2006-11-29 CN disclosed
CN-1611589-A Lubricating oil composition CHINA PETROCHEMICAL CO LTD (CN) 2005-05-04 CN disclosed