SCHEMBL8006468

SCHEMBL8006468

CCC(c1ccc(F)cc1)C(OB(OC(c1ccc(F)cc1)(c1ccc(F)cc1)C(CC)c1ccc(F)cc1)OC(c1ccc(F)cc1)(c1ccc(F)cc1)C(CC)c1ccc(F)cc1)(c1ccc(F)cc1)c1ccc(F)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.32
TDO2 P48775 2/20 0.32
FAAH O00519 1/20 0.32
HPGD P15428 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
AOC3 Q16853 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CASR P41180 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP17A1 P05093 1/20 0.30
SLC6A9 P48067 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
SCHEMBL8006470 0.88 LMNA (0.33) FAAHHPGDMEN1KMT2AAOC3
SCHEMBL8016587 0.85 GRIA4 (0.36) HPGDALDH1A1LMNA
SCHEMBL8016536 0.85 FAAH (0.34) FAAHHPGDMEN1KMT2ASLC6A2
SCHEMBL5528717 0.84 ALDH1A1 (0.40) AOC3ALDH1A1CYP17A1
Tetramethylammonium Ion SCHEMBL3360762 0.82 SLC6A9 (0.31) FAAHSLC6A9
SCHEMBL4530142 0.80 LMNA (0.37) MEN1KMT2ALMNA
Tetrylammonium SCHEMBL3361503 0.80
SCHEMBL8715292 0.75 ALDH1A1 (0.31) IDO1TDO2HPGDMEN1KMT2A
SCHEMBL8016538 0.74 FAAH (0.35) FAAHHPGDMEN1KMT2ASLC6A2
SCHEMBL8016591 0.73 LMNA (0.35) HPGDMEN1KMT2AALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6096794-A PHOTOINITIATOR SYSTEM FOR PHOTOPOLYMERIZATION OF ETHYLENICALLY UNSATURATED POLYMERIZABLE COMPOUNDS CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-08-01 US disclosed
US-6090865-A PHOTOINITIATOR SYSTEM COMPRISING (A) AT LEAST ONE O-ALKYLATED AROMATIC NITROGEN-HETEROCYCLE AMINE OXIDE CATION SALT AND (B) AT LEAST ONE ELECTRON DONOR COMPOUND. CIBA SPECIALTY CHEMICALS CORPORATION (US) 2000-07-18 US disclosed
EP-0896587-A1 POLYMERISABLE COMPOSITION Ciba SC Holding AG (CH) 1999-02-17 EP disclosed
WO-1997042227-A1 POLYMERISABLE COMPOSITION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 1997-11-13 WO disclosed
EP-0434437-A2 Photohardenable or thermohardenable compositions and photosensitive materials utilising such photohardenable compositions THE MEAD CORPORATION (US) 1991-06-26 EP disclosed