SCHEMBL7212084

SCHEMBL7212084

CCCC(C1CC(C)(C)N(C)C(C)(C)C1)(C1CC(C)(C)N(C)C(C)(C)C1)C(C(=O)O)C(=O)OCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.37
HTT P42858 2/20 0.37
PKM P14618 1/20 0.37
ALDH1A1 P00352 7/20 0.33
KDM4E B2RXH2 4/20 0.33
MAPT P10636 3/20 0.33
KMT2A Q03164 2/20 0.32
HMGCR P04035 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 2/20 0.31
ALOX15 P16050 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30

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
SCHEMBL3450609 0.81 ALDH1A1 (0.36) GAAHTTPKMALDH1A1KDM4E
SCHEMBL11067335 0.81 GAA (0.33) GAA
SCHEMBL21822067 0.79 GAA (0.37) GAAHTTPKMALDH1A1KDM4E
SCHEMBL7766757 0.78 GAA (0.36) GAAHTTPKMALDH1A1KDM4E
SCHEMBL1695272 0.78 GAA (0.36) GAAHTTPKMALDH1A1KDM4E
SCHEMBL14053901 0.76 TSHR (0.37) TSHR
SCHEMBL21295451 0.76 GAA (0.37) GAAHTTPKMALDH1A1KDM4E
SCHEMBL3836055 0.76 GAA (0.37) GAAHTTPKMALDH1A1KDM4E
SCHEMBL1695268 0.76 GAA (0.37) GAAHTTPKMALDH1A1KDM4E
SCHEMBL697946 0.75 HMGCR (0.36) GAAHTTPKMALDH1A1KDM4E

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-6608122-B1 O-Hydroxyphenyl-s-triazines in combination with sterically hindered amines of the polyalkylpiperidine type CIBA SPECIALTY CHEMICALS CORPORATION 2003-08-19 US claimed
US-6608122-B1 O-Hydroxyphenyl-s-triazines in combination with sterically hindered amines of the polyalkylpiperidine type CIBA SPECIALTY CHEMICALS CORPORATION 2003-08-19 US disclosed
US-5736597-A USING O-HYDROXYPHENYL-S-TRIAZINE AND STERIC HINDERED AMINE OF THE POLYALKYLPIPERIDINE TYPE CIBA-GEIGY CORPORATION (US) 1998-04-07 US disclosed