SCHEMBL3786141

SCHEMBL3786141

[CH2]COC(=O)OCc1ccco1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.64
MAPK1 P28482 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
POLB P06746 2/20 0.48
TSHR P16473 2/20 0.48
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 1/20 0.46
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45
SLC1A1 P43005 1/20 0.45
ALOX5 P09917 1/20 0.45
GAA P10253 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
MGLL Q99685 1/20 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
SCHEMBL14991432 0.93 ALDH1A1 (0.72) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL8687689 0.84 ALDH1A1 (0.67) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL3785783 0.81 ALDH1A1 (0.68) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL3790125 0.80 ALDH1A1 (0.66) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL6443452 0.79 ALDH1A1 (0.70) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL6443447 0.79 ALDH1A1 (0.70) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL8687685 0.78 ALDH1A1 (0.63) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL15911893 0.78 ALDH1A1 (0.58) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL11002726 0.78 ALDH1A1 (0.68) ALDH1A1MAPK1TDP1POLBTSHR
SCHEMBL11002356 0.78 ALDH1A1 (0.68) ALDH1A1MAPK1TDP1POLBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2159227-B1 Two-photon absorption material and application thereof RICOH CO LTD (JP) 2014-08-06 EP claimed
EP-2159227-B1 Two-photon absorption material and application thereof RICOH CO LTD (JP) 2014-08-06 EP disclosed
EP-2243783-B1 Bisporphyrin conjugates as two photon absorption materials RICOH CO LTD (JP) 2014-01-01 EP disclosed
US-8207330-B2 Two-photon absorption material and application thereof RICOH COMPANY, LTD. (JP) 2012-06-26 US disclosed
EP-2243782-A2 Two-photon absorption material and application thereof Ricoh Company, Ltd. (JP) 2010-10-27 EP disclosed
EP-2243783-A1 Bisporphyrin conjugates as two photon absorption materials Ricoh Company, Ltd. (JP) 2010-10-27 EP disclosed
US-20100056775-A1 TWO-PHOTON ABSORPTION MATERIAL AND APPLICATION THEREOF RICOH COMPANY, LTD. (JP) 2010-03-04 US disclosed
EP-2159227-A1 Two-photon absorption material and application thereof Ricoh Company, Ltd. (JP) 2010-03-03 EP disclosed
US-5877301-A COLOR RECORDING MITSUBISHI CHEMICAL CORPORATION (JP) 1999-03-02 US disclosed
US-5587372-A BACERICIDES ROUSSEL UCLAF (FR) 1996-12-24 US disclosed
EP-0442466-B1 Thermal transfer recording sheet and ink composition for producing the same MITSUBISHI CHEM IND (JP) 1995-01-18 EP disclosed
US-5246911-A Binder and pyridone type azo dye MITSUBISHI KASEI CORPORATION (JP) 1993-09-21 US disclosed
US-5189008-A Containing pyridone-type azo dye MITSUBISHI KASEI CORPORATION (JP) 1993-02-23 US disclosed
EP-0442466-A1 Thermal transfer recording sheet and ink composition for producing the same Mitsubishi Chemical Corporation (JP) 1991-08-21 EP disclosed
EP-0441396-A1 Thermal transfer recording sheet and ink composition for producing the same MITSUBISHI KASEI CORPORATION (JP) 1991-08-14 EP disclosed