SCHEMBL29154145

SCHEMBL29154145

CCCCOC(C)OC(=O)C(Cl)(Cl)Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
LMNA P02545 4/20 0.34
ATM Q13315 1/20 0.33
TSHR P16473 5/20 0.33
CA1 P00915 2/20 0.32
HPGD P15428 1/20 0.32
FAAH O00519 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
CYP1A2 P05177 2/20 0.31
CYP2C19 P33261 2/20 0.31
ESR1 P03372 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPK1 P28482 1/20 0.31
NR1H2 P55055 1/20 0.31
RNASEL Q05823 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 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
SCHEMBL247190 0.84 PRKCA (0.37) ALDH1A1LMNAATMTSHRCA1
SCHEMBL21582010 0.83 ALDH1A1 (0.33) ALDH1A1ATMTSHRHPGDESR1
SCHEMBL10693911 0.81 LMNA (0.44) LMNA
SCHEMBL2735479 0.81 ALDH1A1 (0.34) ALDH1A1LMNAATMTSHRCA1
SCHEMBL1469667 0.79 ALDH1A1 (0.41) ALDH1A1LMNAATMTSHRCA1
SCHEMBL7716277 0.77 ALDH1A1 (0.40) ALDH1A1LMNAATMTSHRCA1
SCHEMBL133243 0.77 ALDH1A1 (0.50) ALDH1A1LMNAATMTSHRCA1
SCHEMBL5933221 0.77 ALDH1A1 (0.40) ALDH1A1LMNAATMTSHRCA1
SCHEMBL15588337 0.77 LMNA (0.34) ALDH1A1LMNAATMTSHRSMN1; SMN2
SCHEMBL10562494 0.76 LMNA (0.39) ALDH1A1LMNAATMTSHRCA1

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-119064537-A Herbicide phytotoxicity evaluation method for potato plants and potato blocks 恩施土家族苗族自治州农业科学院(硒应用技术与产品开发研究院) 2024-12-03 CN disclosed
CN-117546860-A Weeding composition 青岛滕润翔检测评价有限公司 2024-02-13 CN disclosed