SCHEMBL3091854

SCHEMBL3091854

O=C(O)c1ccc(C(=O)O)c2c1CCCCCCCC2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.55
GFER P55789 1/20 0.44
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 3/20 0.42
MAPT P10636 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
ALOX15 P16050 1/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
RAB9A P51151 1/20 0.42
FABP4 P15090 5/20 0.41
XDH P47989 1/20 0.40
TSHR P16473 2/20 0.39
SELL P14151 1/20 0.39
SELP P16109 1/20 0.39
RXRA P19793 3/20 0.39
RXRB P28702 2/20 0.39
RXRG P48443 2/20 0.39
HPGD P15428 2/20 0.38
HSD17B10 Q99714 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
SCHEMBL3107923 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL2034342 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL250454 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL195800 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
Cyclohexane SCHEMBL1538047 1.00 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL87519 0.97 CYP1A2 (0.57) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL982478 0.95 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EMAPT
Cyclohexane SCHEMBL483378 0.92 CYP1A2 (0.57) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL251512 0.92 CYP1A2 (0.57) CYP1A2GFERALDH1A1KDM4EMAPT
SCHEMBL973641 0.90 CYP1A2 (0.55) CYP1A2GFERALDH1A1KDM4EALOX15

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9760032-B1 Toner composition and process XEROX CORPORATION (US) 2017-09-12 US claimed
US-20170248859-A1 TONER COMPOSITION AND PROCESS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2017-08-31 US claimed
US-7785763-B2 Emulsion aggregation processes XEROX CORPORATION (US) 2010-08-31 US claimed
US-5591559-A Supercritical toner processes XEROX CORPORATION (US) 1997-01-07 US claimed
EP-3367170-B1 TONER COMPOSITIONS XEROX CORP (US) 2019-09-25 EP disclosed
US-10078282-B2 Toner compositions and processes XEROX CORPORATION (US) 2018-09-18 US disclosed
EP-3367170-A1 TONER COMPOSITIONS AND PROCESSES Xerox Corporation (US) 2018-08-29 EP disclosed
US-9971265-B1 Toner compositions and processes XEROX CORPORATION (US) 2018-05-15 US disclosed
US-9760032-B1 Toner composition and process XEROX CORPORATION (US) 2017-09-12 US disclosed
US-20170248859-A1 TONER COMPOSITION AND PROCESS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS COLLATERAL AGENT 2017-08-31 US disclosed
US-9740124-B2 Toner compositions and processes XEROX CORPORATION (US) 2017-08-22 US disclosed
EP-3160296-A1 TOOTHBRUSH HAVING MOVABLE ELEMENTS Trisa Holding AG (CH) 2017-05-03 EP disclosed
US-5981651-A Ink processes XEROX CORPORATION (US) 1999-11-09 US disclosed
US-5847030-A Latex processes XEROX CORPORATION (US) 1998-12-08 US disclosed
EP-0671664-B1 Process for the preparation of toner compositions XEROX CORP (US) 1998-05-13 EP disclosed
US-5622806-A MIXING PIGMENT, IONIC SURFACTANT AND WATER, SHEARING WITH LATEX MIXTURE HAVING COUNTERIONIC AND NONIONIC SURFACTANT AND RESIN PARTICLES TO FLOCCULATE, STIRRING, HEATING, COALESCING, WASHING, ADDING HYDROPHILIC AND HYDROPHOBIC OXIDES XEROX CORPORATION (US) 1997-04-22 US disclosed
US-5567566-A PREPARING TONER PARTICLES BY SHEARING PIGMENT DISPERSION WITH LATEX FORMED FROM PREEMULSIFIED MONOMER MIXTURE, STIRRING FLOCCULATED PARTICLES, ADDING SURFACTANT TO PREVENT FURTHER PARTICLE GROWTH, HEATING TO COALESCE XEROX CORPORATION (US) 1996-10-22 US disclosed
EP-0104543-B1 RESIN COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 1987-04-22 EP disclosed
US-4528346-A Resin composition Dainippun Ink and Chemicals, Inc. (JP) 1985-07-09 US disclosed
EP-0104543-A1 Resin composition DAINIPPON INK AND CHEMICALS, INC. (JP) 1984-04-04 EP disclosed