SCHEMBL9854446

SCHEMBL9854446

C=CC(=O)OCCONC(=O)c1ccccc1C(=O)NOCCOC(=O)C=C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.54
TSHR P16473 7/20 0.46
ALDH1A1 P00352 4/20 0.46
TP53 P04637 2/20 0.46
HIF1A Q16665 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP3A4 P08684 2/20 0.42
HDAC3 O15379 2/20 0.40
HDAC4 P56524 2/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC7 Q8WUI4 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC10 Q969S8 2/20 0.40
HDAC11 Q96DB2 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC9 Q9UKV0 2/20 0.40
HDAC5 Q9UQL6 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LIG1 P18858 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
SCHEMBL3875850 0.84 THRB (0.49) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL28639081 0.79 THRB (0.38) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL9056143 0.78 HDAC8 (0.44) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL228020 0.78 THRB (0.62) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL7776152 0.75 TSHR (0.60) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL3865779 0.75 TSHR (0.50) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL9854650 0.75 TSHR (0.51) THRBTSHRALDH1A1HSD17B10CYP3A4
SCHEMBL19291843 0.75 MAPK1 (0.52) THRBTSHRKDM4EKMT2ACYP1A2
SCHEMBL5848878 0.75 MAPK1 (0.52) THRBTSHRKDM4EKMT2ACYP1A2
SCHEMBL9703918 0.74 HDAC3 (0.47) TSHRHDAC3HDAC4HDAC1HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0412851-A2 Photosensitive member and multi-color image forming method CANON KABUSHIKI KAISHA (JP) 1991-02-13 EP disclosed
EP-0411839-A2 Image forming medium and image forming method CANON KABUSHIKI KAISHA (JP) 1991-02-06 EP disclosed
EP-0363790-A2 Image forming method and image forming medium CANON KABUSHIKI KAISHA (JP) 1990-04-18 EP disclosed
EP-0362827-A1 Image forming method and image forming medium CANON KABUSHIKI KAISHA (JP) 1990-04-11 EP disclosed
EP-0360014-A1 Photosensitive material and image forming method using same CANON KABUSHIKI KAISHA (JP) 1990-03-28 EP disclosed