SCHEMBL4555764

SCHEMBL4555764

CC(CCO)CCOC(=O)OCCCCCCO

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 6/20 0.40
▸ ALOX15 P16050 2/20 0.38
▸ CHRNB2 P17787 2/20 0.33
▸ CHRNB4 P30926 2/20 0.33
▸ CHRNA3 P32297 2/20 0.33
▸ CHRNA4 P43681 2/20 0.33
▸ NAAA Q02083 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP4F2 P78329 2/20 0.32
▸ CYP4A11 Q02928 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ EPHX1 P07099 1/20 0.31

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
SCHEMBL25965494 1.00 ACHE (0.40) ACHEALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL26735085 0.96 ALOX15 (0.40) ACHEALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL25965470 0.96 ALOX15 (0.40) ACHEALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL4555785 0.89 ALOX15 (0.44) ALOX15CHRNB2CHRNB4CHRNA3CHRNA4
SCHEMBL4556405 0.82 ACHE (0.40) ACHENAAACYP4F2CYP4A11GAA
SCHEMBL26735185 0.81 ALOX15 (0.37) ACHEALOX15CHRNB2CHRNB4CHRNA3
SCHEMBL3114601 0.80 ACHE (0.48) ACHENAAAALDH1A1CYP4F2CYP4A11
SCHEMBL28559079 0.80 ACHE (0.48) ACHENAAAALDH1A1CYP4F2CYP4A11
SCHEMBL21143379 0.80 ACHE (0.48) ACHENAAAALDH1A1CYP4F2CYP4A11
SCHEMBL21143358 0.80 ACHE (0.48) ACHENAAAALDH1A1CYP4F2CYP4A11

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-20090312444-A1 CAST MOLDED ARTICLE MADE OF POLYURETHANE POROUS SUBSTANCE AND METHOD FOR PRODUCING THE SAME TOYO POLYMER CO., LTD. (JP) 2009-12-17 — — US disclosed
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