SCHEMBL8018671

SCHEMBL8018671

CCCCCCC(c1ccc(OC)cc1)C(OB(O)O)(c1ccc(OC)cc1)c1ccc(OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 4/20 0.39
MMP13 P45452 4/20 0.39
ADAM17 P78536 4/20 0.39
MMP1 P03956 4/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
SLC2A1 P11166 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
FAAH O00519 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33

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
Tetramethylammonium Ion SCHEMBL2850966 0.96 MEN1 (0.37) MMP9MMP13ADAM17MMP1MEN1
SCHEMBL8019381 0.95 MEN1 (0.36) MMP9MMP13MMP1MEN1KMT2A
Tetramethylammonium Ion SCHEMBL8006459 0.91 MEN1 (0.35) MMP9MMP13MMP1MEN1KMT2A
SCHEMBL8018667 0.90 SLC2A1 (0.39) MMP9MMP13ADAM17MMP1MEN1
SCHEMBL8023308 0.84 MEN1 (0.39) MMP9MMP1MEN1KMT2AMMP2
SCHEMBL8019378 0.84 MMP13 (0.37) MMP9MMP13MMP1MEN1KMT2A
SCHEMBL1618141 0.84 MIF (0.38) ALDH1A1
SCHEMBL25409960 0.83 LMNA (0.39) MEN1KMT2ASLC2A1ALDH1A1HDAC3
SCHEMBL8016478 0.83 MEN1 (0.38) MEN1KMT2AMMP2MMP3ALDH1A1
SCHEMBL25406912 0.82 CYP1A2 (0.36) MEN1KMT2AFAAHALDH1A1

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 4 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