SCHEMBL6017070

SCHEMBL6017070

CCCCCCCCCCSC(C)OC(=O)C(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
ALDH1A1 P00352 3/20 0.38
TSHR P16473 3/20 0.38
LMNA P02545 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
MAPK1 P28482 2/20 0.38
BLM P54132 2/20 0.38
ATM Q13315 2/20 0.38
HIF1A Q16665 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
GMNN O75496 1/20 0.38
GABBR2 O75899 1/20 0.38
TP53 P04637 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
NFKB1 P19838 1/20 0.38
CYP2C19 P33261 1/20 0.38
PMP22 Q01453 1/20 0.38

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
SCHEMBL39424 0.84 KMT2A (0.37) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL17627921 0.84 KMT2A (0.37) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL7574072 0.83 KMT2A (0.39) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL549451 0.81 KMT2A (0.39) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL578530 0.80 KMT2A (0.39) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL466132 0.80 KMT2A (0.39) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL28540635 0.80 KMT2A (0.39) KMT2AMEN1ALDH1A1TSHRLMNA
SCHEMBL18837646 0.80 GAA (0.46) KMT2AMEN1LMNAGAAHMGCR
SCHEMBL18837638 0.80 GAA (0.46) KMT2AMEN1LMNAGAAHMGCR
SCHEMBL6943013 0.79 LMNA (0.41) LMNAVCAM1EPHX1F2RNR5A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1641768-A2 AMINOARYL-1-3-5 TRIAZINES AND THEIR USE AS UV ABSORBERS Ciba SC Holding AG (CH) 2006-04-05 EP disclosed
WO-2004106311-A2 AMINOARYL-1-3-5 TRIAZINES AND THEIR USE AS UV ABSORBERS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-12-09 WO disclosed