SCHEMBL7941146

SCHEMBL7941146

CC1=C([Ti](C2=C(C)C=CC2)c2ccccc2C(F)(F)F)CC=C1.N=C=O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL8961799 0.92 HSD11B1 (0.32) MEN1KMT2A
Hydrochloric Acid SCHEMBL9005137 0.90 HSD11B1 (0.31) MEN1KMT2A
Thiocyanic Acid SCHEMBL9004794 0.87
Hydrochloric Acid SCHEMBL9547761 0.76 HTR2C (0.31)
SCHEMBL27492537 0.74
SCHEMBL9004769 0.69 HSD11B1 (0.31) MEN1KMT2A
SCHEMBL3720952 0.67 GAA (0.42) MEN1KMT2A
Thiocyanic Acid SCHEMBL9004779 0.66 AR (0.30)
SCHEMBL28833076 0.65
SCHEMBL7907713 0.63 MEN1 (0.30) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6204306-B1 ALPHA-AMINOACETOPHENONES FUNCTIONALIZED WITH ORGANIC DIISOCYANATES, WHICH CAN BE USED AS REACTIVE PHOTOINITIATORS; NOVARTIS AG (CH) 2001-03-20 US disclosed
US-6099122-A REACTING AN OLIGOMER OR POLYMER COTAINING GROUPS COREACTIVE WITH ISOCYANATE GROUPS WITH A FUNCTIONAL PHOTOINITIATOR TO FORM MACROINITIATOR, APPLYING THE THIN LAYER OF MACROINITIATOR TO A REACTIVE SURFACE, IRRIDATING WITH UV RAD CIBA VISION CORPORATION (US) 2000-08-08 US disclosed
US-6087412-A OPHTHALMIC MOLDING BLEND OF MACROMOLECULE CONTAINING PHOTOINITIATOR, HYDROPHILIC VINYL MONOMER AND CROSSLINKER NOVARTIS AG (CH) 2000-07-11 US disclosed
EP-0800511-B1 FUNCTIONALISED PHOTOINITIATORS, DERIVATIVES AND MACROMERS THEREFROM AND THEIR USE NOVARTIS AG (CH) 2000-01-26 EP disclosed
EP-0808222-B1 PROCESS FOR THE FUNCTIONALISATION OF SURFACES NOVARTIS AG (CH) 1999-05-19 EP disclosed
EP-0800511-A1 FUNCTIONALISED PHOTOINITIATORS, DERIVATIVES AND MACROMERS THEREFROM AND THEIR USE Novartis AG (CH) 1997-10-15 EP disclosed
US-5629356-A PHOTOCURABLE COMPOSITION CONTAINING ETHYLENICALLY UNSATURATED PHOTOPOLYMERIZABLE COMPOUND AND THE AMINOACETOPHENONE CIBA GEIGY CORPORATION (US) 1997-05-13 US disclosed
WO-1996020919-A1 FUNCTIONALISED PHOTOINITIATORS, DERIVATIVES AND MACROMERS THEREFROM AND THEIR USE NOVARTIS AG (CH) 1996-07-11 WO disclosed
WO-1996020796-A1 PROCESS FOR THE FUNCTIONALISATION OF SURFACES NOVARTIS AG (CH) 1996-07-11 WO disclosed
US-5288917-A Benzil ketals; end-capped polyoxyyethylene glycol; mixed with titanocene-type initiators CIBA-GEIGY CORPORATION (US) 1994-02-22 US disclosed
US-5077402-A For photocuring pigmented systems; printing inks, lacquers CIBA-GEIGY CORPORATION (US) 1991-12-31 US disclosed