SCHEMBL8894492

SCHEMBL8894492

CCCN(CCC)C(=O)c1ccc(OCCCCOc2c(C)cc(OCC=C(Cl)Cl)cc2CC)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
THRA P10827 4/20 0.37
THRB P10828 4/20 0.37
PLA2G4B P0C869 1/20 0.37
RARB P10826 3/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
MAPT P10636 1/20 0.35
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
F2 P00734 2/20 0.35

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
SCHEMBL8895163 0.98 POLB (0.37) POLBTP53TSHRHTTTHRA
SCHEMBL8895634 0.94 POLB (0.40) POLBTP53TSHRHTTTHRA
SCHEMBL8895488 0.92 POLB (0.40) POLBHTTTHRATHRBPLA2G4B
SCHEMBL8894781 0.89 LSS (0.37) POLBTP53TSHRHTTMAPT
SCHEMBL8910421 0.87 MEN1 (0.36) POLBHTTPLA2G4BMAPTF2
SCHEMBL8895659 0.85 THRB (0.40) POLBTP53TSHRHTTTHRA
SCHEMBL8895295 0.84 POLB (0.40) POLBTP53TSHRHTTTHRA
SCHEMBL8658513 0.83 HTT (0.41) HTTMAPT
SCHEMBL8896466 0.83 LSS (0.39) POLBHTTMAPTF2
SCHEMBL8897483 0.82 MAOB (0.42) POLBTP53TSHRHTTTHRA

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
WO-1997027173-A2 DIHALOPROPENE COMPOUNDS, THEIR USE AS INSECTICIDES/ACARICIDES AND INTERMEDIATES FOR THEIR PRODUCTION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-07-31 WO disclosed