SCHEMBL3459899

SCHEMBL3459899

C=CCOC(=O)C(C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
TSHR P16473 4/20 0.40
CYP3A4 P08684 2/20 0.38
MAPT P10636 3/20 0.36
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP2C9 P11712 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPK1 P28482 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6476278 0.89 TDP1 (0.48) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL28211502 0.83 TDP1 (0.42) TDP1TSHRCYP3A4ALDH1A1HSD17B10
SCHEMBL6483817 0.83 TDP1 (0.44) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL440465 0.83 TDP1 (0.44) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL452543 0.81 TDP1 (0.43) TDP1TSHRCYP3A4MAPTCACNA1B
Lactic Acid SCHEMBL27586439 0.81 TP53 (0.46) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL17662069 0.81 TDP1 (0.43) TDP1TSHRCYP3A4MAPTCACNA1B
SCHEMBL536216 0.79
SCHEMBL19204927 0.79 TSHR (0.39) TDP1TSHRCYP3A4MAPTALDH1A1
SCHEMBL8725865 0.79 TDP1 (0.42) TDP1TSHRCYP3A4MAPTCACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109021220-A A kind of long acting antibiotic polymer and its preparation method and application 贾勋 2018-12-18 CN disclosed
US-7790352-B2 Lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2010-09-07 US disclosed
EP-1674928-B1 Lithographic printing plate precursor FUJIFILM CORP (JP) 2008-12-03 EP disclosed
EP-1992989-A1 Lithographic printing plate precursor FUJIFILM Corporation (JP) 2008-11-19 EP disclosed
US-7435532-B2 Lithographic printing plate precursor FUJIFILM CORPORATION (JP) 2008-10-14 US disclosed
US-20080227026-A1 Lithographic printing plate precursor ODA AKIO 2008-09-18 US disclosed
US-20070076072-A1 Ink composition for ink jet recording and method for producing planographic printing plate using the same FUJI PHOTO FILM CO., LTD. 2007-04-05 US disclosed
EP-1770131-A1 Ink composition for ink jet recording and method for producing planographic printing plate using the same FUJIFILM Corporation (JP) 2007-04-04 EP disclosed
US-20060199097-A1 Lithographic printing plate precursor FUJI PHOTO FILM CO. LTD (JP) 2006-09-07 US disclosed
EP-1674928-A2 Lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 2006-06-28 EP disclosed
EP-0398373-A1 Electrophotographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1990-11-22 EP disclosed
US-4971870-A OFFSET PRINTING, ELECTROCONDUCTORS, PHOTOCONDUCTORS, BINDER RESINS, MULTILAYER FUJI PHOTO FILM CO., LTD. (JP) 1990-11-20 US disclosed
EP-0376650-A2 Liquid developer for electrostatic photography FUJI PHOTO FILM CO., LTD. (JP) 1990-07-04 EP disclosed
EP-0366447-A2 Electrostatic photographic liquid developer FUJI PHOTO FILM CO., LTD. (JP) 1990-05-02 EP disclosed
EP-0362804-A2 Electrophotographic photoreceptor FUJI PHOTO FILM CO., LTD. (JP) 1990-04-11 EP disclosed
EP-0352697-A2 Electrophotographic photoreceptor FUJI PHOTO FILM CO., LTD. (JP) 1990-01-31 EP disclosed
EP-0341825-A2 An electrophotographic lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 1989-11-15 EP disclosed
EP-0333415-A2 An electrophotographic lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 1989-09-20 EP disclosed
EP-0326132-A2 Electrophotographic lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 1989-08-02 EP disclosed
EP-0325258-A2 Electrophotographic lithographic printing plate precursor FUJI PHOTO FILM CO., LTD. (JP) 1989-07-26 EP disclosed