Butylated Hydroxytoluene

Butylated Hydroxytoluene

SCHEMBL6901302

Cc1cc(C(C)(C)C)c([O-])c(C(C)(C)C)c1.[Cs+]

nearest known ligand 0.54

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.54
ALDH1A1 P00352 5/20 0.54
TYR P14679 2/20 0.54
CA2 P00918 2/20 0.54
POLB P06746 1/20 0.54
HSPA5 P11021 1/20 0.43
CYP2C9 P11712 4/20 0.42
CYP2C19 P33261 3/20 0.42
HIF1A Q16665 3/20 0.42
HSD17B10 Q99714 2/20 0.37
CYP2D6 P10635 2/20 0.37
TSHR P16473 3/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALOX15 P16050 3/20 0.36
CYP1A2 P05177 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
ATP2A2 P16615 1/20 0.36
ATP2A3 Q93084 1/20 0.36
HTT P42858 2/20 0.34

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
Butylated Hydroxytoluene SCHEMBL4820691 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL4826096 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL864243 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL6908300 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL20455508 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL23090058 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL17835978 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL7738522 0.95 SMN1; SMN2 (0.54) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL6039994 0.92 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1TYRCA2POLB
Butylated Hydroxytoluene SCHEMBL17836004 0.92 ALDH1A1 (0.52) SMN1; SMN2ALDH1A1TYRCA2POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040147655-A1 Aromatic polycarbonate resin composition TEIJIN LIMITED (JP) 2004-07-29 US disclosed
EP-1275694-A1 AROMATIC POLYCARBONATE COMPOSITION, PROCESS FOR PRODUCING THE SAME, AND MOLDED ARTICLE THEREOF TEIJIN LIMITED (JP) 2003-01-15 EP disclosed
US-20020103328-A1 Aromatic polycarbonate composition, production process therefor and molded product thereof TEIJIN LIMITED 2002-08-01 US disclosed