SCHEMBL27465218

SCHEMBL27465218

O=C1C(=O)N(c2cc(Cl)c(O)c(Cl)c2)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 9/20 0.60
ALDH1A1 P00352 4/20 0.60
BCHE P06276 4/20 0.60
GAA P10253 2/20 0.60
CES2 O00748 2/20 0.60
NPSR1 Q6W5P4 1/20 0.60
ALOX15 P16050 2/20 0.43
HSD17B10 Q99714 2/20 0.43
APAF1 O14727 1/20 0.43
TP53 P04637 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43
ACHE P22303 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43

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
SCHEMBL27465704 0.85 CES1 (0.57) CES1ALDH1A1BCHEGAACES2
SCHEMBL27465705 0.81 CES1 (0.60) CES1ALDH1A1BCHEGAACES2
SCHEMBL5352173 0.77 CES1 (0.73) CES1ALDH1A1BCHEGAACES2
Phenyl Isatin SCHEMBL916808 0.76 CES1 (1.00) CES1ALDH1A1BCHEGAACES2
Phenyl Isatin SCHEMBL1897654 0.76 CES1 (0.83) CES1ALDH1A1BCHEGAACES2
SCHEMBL31413343 0.76 CES1 (0.66) CES1ALDH1A1BCHEGAACES2
SCHEMBL21925200 0.76 CES1 (0.66) CES1ALDH1A1BCHEGAACES2
SCHEMBL18020245 0.74 CES1 (0.69) CES1ALDH1A1BCHEGAACES2
SCHEMBL30596238 0.73 CES1 (0.58) CES1ALDH1A1BCHEGAACES2
SCHEMBL30596240 0.73 CES1 (0.58) CES1ALDH1A1BCHEGAACES2

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
CN-1132216-A Copolycarbonate, copolycarbonate composition, and method for their manufacture GEN ELECTRIC (US) 1996-10-02 CN disclosed