SCHEMBL10050683

SCHEMBL10050683

C=C(C)C(=O)OCCOc1ccc(C(=O)c2ccc(C#N)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.63
ALDH1A1 P00352 1/20 0.63
POLB P06746 1/20 0.56
APEX1 P27695 1/20 0.56
HTT P42858 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
MMP2 P08253 4/20 0.46
MMP3 P08254 2/20 0.46
ELANE P08246 1/20 0.46
VNN1 O95497 1/20 0.45
RAB9A P51151 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.42
LMNA P02545 2/20 0.42
MMP1 P03956 1/20 0.42
MMP9 P14780 1/20 0.42
MMP13 P45452 1/20 0.42
GAA P10253 2/20 0.41
PARP15 Q460N3 1/20 0.41
PARP10 Q53GL7 1/20 0.41
PARP2 Q9UGN5 1/20 0.41

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
SCHEMBL7578689 0.89 MAPT (0.58) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL7586000 0.86 MAPT (0.55) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL10035132 0.86 MAPT (0.55) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL9004246 0.86 ALDH1A1 (0.55) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL7561622 0.86 ALDH1A1 (0.55) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL25123515 0.86 MAPT (0.55) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL8820401 0.86 MAPT (0.55) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL10050684 0.85 TDP1 (0.60) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL1067982 0.85 HTT (0.64) MAPTALDH1A1POLBAPEX1HTT
SCHEMBL2405588 0.85 POLB (0.60) MAPTALDH1A1POLBAPEX1HTT

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-20210171688-A1 BIOCOMPATIBLE COPOLYMER, CURABLE COMPOSITION, BIOCOMPATIBLE COATING LAYER AND BIOCOMPATIBLE DEVICE INCLUDING THE SAME NATIONAL CENTRAL UNIVERSITY (TW) 2021-06-10 US disclosed
US-20150132544-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
US-20150132544-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2015-05-14 US disclosed
EP-2228417-B1 Ink composition and inkjet recording method FUJIFILM CORP (JP) 2015-01-07 EP disclosed
US-20120213978-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-08-23 US disclosed
US-20120213978-A1 INK COMPOSITION, IMAGE FORMING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2012-08-23 US disclosed
US-8097688-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-01-17 US disclosed
US-8097688-B2 Ink composition and inkjet recording method FUJIFILM CORPORATION (JP) 2012-01-17 US disclosed
EP-2228417-A1 Ink composition and inkjet recording method Fujifilm Corporation (JP) 2010-09-15 EP disclosed
US-20100227076-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-09 US disclosed
US-20100227076-A1 INK COMPOSITION AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2010-09-09 US disclosed