SCHEMBL3287748

SCHEMBL3287748

CCCCOC(C)(CCC)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
ATM Q13315 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
TSHR P16473 2/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.35
PLA2G4B P0C869 2/20 0.35
HPGD P15428 1/20 0.34
ELANE P08246 1/20 0.34
PPARA Q07869 1/20 0.34
RARB P10826 3/20 0.33

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
SCHEMBL3284825 0.94 ALDH1A1 (0.40) ALDH1A1ATMHCAR2TSHRTP53
SCHEMBL17023982 0.90 TP53 (0.42) ALDH1A1HCAR2TSHRTP53PLA2G4B
SCHEMBL17023984 0.90 TP53 (0.42) ALDH1A1HCAR2TSHRTP53PLA2G4B
SCHEMBL2477671 0.89 TP53 (0.45) TSHRTP53PLA2G4BRARB
SCHEMBL28023365 0.89 TP53 (0.45) TSHRTP53PLA2G4BRARB
SCHEMBL28023410 0.89 TP53 (0.45) TSHRTP53PLA2G4BRARB
SCHEMBL12804020 0.89 TP53 (0.45) TSHRTP53PLA2G4BRARB
SCHEMBL689136 0.89 TP53 (0.45) TSHRTP53PLA2G4BRARB
SCHEMBL3284625 0.86 ALDH1A1 (0.40) ALDH1A1ATMHCAR2TSHRTP53
SCHEMBL3285404 0.82 ALDH1A1 (0.35) ALDH1A1ATMHCAR2TSHRTP53

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
US-7713677-B2 Photoresist composition, method of patterning thin film using the same, and method of manufacturing liquid crystal display panel using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-05-11 US disclosed
US-20070190454-A1 PHOTORESIST COMPOSITION, METHOD OF PATTERNING THIN FILM USING THE SAME, AND METHOD OF MANUFACTURING LIQUID CRYSTAL DISPLAY PANEL USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2007-08-16 US disclosed