SCHEMBL7796733

SCHEMBL7796733

BOC(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 8/20 0.43
TDO2 P48775 8/20 0.43
DPP4 P27487 2/20 0.41
TSHR P16473 2/20 0.41
F2 P00734 1/20 0.41
SCN1A P35498 2/20 0.40
SCN2A Q99250 2/20 0.40
SCN3A Q9NY46 2/20 0.40
CHRM2 P08172 2/20 0.40
CHRM4 P08173 2/20 0.40
CHRM5 P08912 2/20 0.40
ADRA2A P08913 2/20 0.40
CHRM1 P11229 2/20 0.40
ADRA2B P18089 2/20 0.40
CHRM3 P20309 2/20 0.40
SLC6A2 P23975 2/20 0.40
HRH2 P25021 2/20 0.40
HTR2A P28223 2/20 0.40
HTR2C P28335 2/20 0.40
SLC6A4 P31645 2/20 0.40

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
SCHEMBL14380217 0.86 MEN1 (0.43) IDO1TDO2TSHRSCN1ASCN2A
SCHEMBL127629 0.75 IDO1 (0.46) IDO1TDO2DPP4TSHRF2
Methane SCHEMBL29089947 0.73 IDO1 (0.44) IDO1TDO2DPP4TSHRF2
Ammonia Solution, Strong SCHEMBL7282272 0.73 IDO1 (0.44) IDO1TDO2DPP4TSHRF2
Water SCHEMBL11878861 0.73 IDO1 (0.44) IDO1TDO2DPP4TSHRF2
SCHEMBL7099520 0.72 TSHR (0.50) IDO1TDO2DPP4TSHRF2
SCHEMBL907605 0.72 HCAR2 (0.42) DPP4F2ADRA2AADRA2BLMNA
SCHEMBL20527054 0.72 DPP4 (0.38) DPP4TSHRF2HTR2AHRH1
SCHEMBL14380354 0.72 SLC6A4 (0.31) IDO1TDO2SLC6A4SLC6A3HRH4
SCHEMBL14380352 0.71 SCN1A (0.55) TSHRSCN1ASCN2ASCN3ACHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0983222-B1 PHARMACEUTICAL AGENTS FOR THE TREATMENT OF CEREBRAL AMYLOIDOSIS NYMOX CORP (CA) 2007-11-28 EP disclosed
EP-0808849-B1 Process for the production of ethylenic polymers SHOWA DENKO KK (JP) 2001-12-19 EP disclosed
US-6011127-A CATALYST COMPRISING A CHROMIUM COMPOUND, AN ALUMOXANE AND AN ORGANOMETALLIC ALKOXIDE AND/OR ORGANOMETALLIC SILOXIDE AND A CARRIER SUPPORTING THEREON THESE COMPOUNDS. SHOWA DENKO K.K. (JP) 2000-01-04 US disclosed
EP-0574258-B1 Process for producing alpha-olefin polymers MITSUBISHI CHEM CORP (JP) 1998-01-14 EP disclosed
EP-0808849-A1 Process for the production of ethylenic polymers SHOWA DENKO KABUSHIKI KAISHA (JP) 1997-11-26 EP disclosed
EP-0574258-A2 Process for producing alpha-olefin polymers MITSUBISHI CHEMICAL CORPORATION (JP) 1993-12-15 EP disclosed
US-3946131-A Glass fibers coated with silicon containing aminimide compounds OWENS-CORNING FIBERGLAS CORPORATION (US) 1976-03-23 US disclosed