SCHEMBL8227403

SCHEMBL8227403

CCCCCOc1ccc(OCC)c(OCC)c1OCCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 4/20 0.40
▸ KMT2A Q03164 4/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ LMNA P02545 3/20 0.40
▸ POLB P06746 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PLA2G1B P04054 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ ATG4B Q9Y4P1 1/20 0.40
▸ MAPT P10636 3/20 0.40
▸ MCHR1 Q99705 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ CASP1 P29466 1/20 0.40

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
SCHEMBL8224344 0.94 ALDH1A1 (0.43) L3MBTL1ALDH1A1KDM4EKMT2AMEN1
SCHEMBL8225071 0.94 L3MBTL1 (0.47) L3MBTL1ALDH1A1KDM4EKMT2AMEN1
SCHEMBL8220033 0.92 ALDH1A1 (0.44) L3MBTL1ALDH1A1KDM4EKMT2AMEN1
SCHEMBL8223215 0.88 CYP1A2 (0.47) L3MBTL1ALDH1A1KDM4EKMT2AMEN1
SCHEMBL1984241 0.82 CYP1A2 (0.52) L3MBTL1ALDH1A1KDM4ELMNASMN1; SMN2
SCHEMBL27859464 0.81 L3MBTL1 (0.37) L3MBTL1ALDH1A1KMT2AMEN1HTT
SCHEMBL9196941 0.79 ALDH1A1 (0.48) L3MBTL1ALDH1A1KDM4EKMT2AMEN1
SCHEMBL15120821 0.79 L3MBTL1 (0.56) L3MBTL1ALDH1A1KMT2AMEN1LMNA
SCHEMBL1837034 0.78 ESR1 (0.49) KMT2AMEN1LMNAMAPTESR1
SCHEMBL7306616 0.78 LMNA (0.42) ALDH1A1KDM4EKMT2AMEN1LMNA

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
US-6140274-A Dihalopropene compounds, their use as insecticides/acaricides and intermediates for their production SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-31 — — US disclosed
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