SCHEMBL27757779

SCHEMBL27757779

CC=CCC(C(=O)OCCCC)C(C)C(=O)OC(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
ATM Q13315 1/20 0.38
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
HCAR2 Q8TDS4 2/20 0.34
RAB9A P51151 3/20 0.33
NPSR1 Q6W5P4 3/20 0.33
MAPT P10636 2/20 0.33
NPC1 O15118 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
TDP1 Q9NUW8 1/20 0.30
NAAA Q02083 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
SCHEMBL27736971 0.91 ATM (0.42) ATMALDH1A1HPGDTSHRHCAR2
SCHEMBL27737032 0.87 ATM (0.39) ATMALDH1A1HPGDTSHRHCAR2
SCHEMBL27737016 0.85 ATM (0.40) ATMALDH1A1HPGDTSHRHCAR2
SCHEMBL27932827 0.85 NAAA (0.42) TSHRHCAR2NAAA
SCHEMBL27736984 0.85 GRIK1 (0.33) LMNATSHRHCAR2
SCHEMBL27737017 0.82 ATM (0.40) ATMALDH1A1HPGDTSHRHCAR2
SCHEMBL29220332 0.82 HCAR2 (0.34) ALDH1A1HCAR2
SCHEMBL29220253 0.79 ATM (0.42) ATMALDH1A1HPGDTSHRHCAR2
SCHEMBL27736978 0.79 GRIK1 (0.38) LMNATSHRHCAR2
SCHEMBL27932829 0.77 HCAR2 (0.42) TSHRHCAR2NAAA

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
CN-101423571-A Olefin polymerization catalytic component and catalyst thereof PETROCHINA CO LTD (CN) 2009-05-06 CN claimed
CN-101423571-A Olefin polymerization catalytic component and catalyst thereof PETROCHINA CO LTD (CN) 2009-05-06 CN disclosed