SCHEMBL19360458

SCHEMBL19360458

C=CC(=O)OCCCCCCOC(=O)c1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.54
DRD3 P35462 1/20 0.54
ALDH1A1 P00352 2/20 0.51
CYP3A4 P08684 2/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 2/20 0.51
KDM4E B2RXH2 2/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 1/20 0.51
EGFR P00533 1/20 0.51
TP53 P04637 1/20 0.51
PKM P14618 1/20 0.51
HPGD P15428 1/20 0.51
ALOX15 P16050 1/20 0.51
ALOX12 P18054 1/20 0.51
JAK1 P23458 1/20 0.51
MAPK1 P28482 1/20 0.51
KMT2A Q03164 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL19759067 0.90 HRH3 (0.48) HRH3DRD3ALDH1A1CYP3A4TSHR
SCHEMBL17445715 0.90 HRH3 (0.48) HRH3DRD3ALDH1A1CYP3A4TSHR
SCHEMBL18024927 0.89 HRH3 (0.56) HRH3DRD3ALDH1A1CYP3A4TDP1
SCHEMBL18024928 0.89 HRH3 (0.56) HRH3DRD3ALDH1A1CYP3A4TDP1
SCHEMBL17487303 0.89 HRH3 (0.56) HRH3DRD3ALDH1A1CYP3A4TDP1
SCHEMBL18622717 0.87 MEN1 (0.49) HRH3DRD3ALDH1A1CYP3A4TSHR
SCHEMBL16885030 0.85 THRB (0.51) HRH3DRD3ALDH1A1CYP3A4TSHR
SCHEMBL16622122 0.84 HRH3 (0.52) HRH3DRD3ALDH1A1TDP1KDM4E
SCHEMBL4570310 0.84 HRH3 (0.66) HRH3DRD3ALDH1A1CYP3A4TDP1
SCHEMBL16893600 0.83 THRB (0.57) HRH3ALDH1A1CYP3A4TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10273373-B2 Ink and method for producing same, and ink stored container, printing method, and printing apparatus RICOH COMPANY, LTD. (JP) 2019-04-30 US disclosed
US-20170267884-A1 INK AND METHOD FOR PRODUCING SAME, AND INK STORED CONTAINER, PRINTING METHOD, AND PRINTING APPARATUS RICOH COMPANY, LTD. (JP) 2017-09-21 US disclosed
US-20170267884-A1 INK AND METHOD FOR PRODUCING SAME, AND INK STORED CONTAINER, PRINTING METHOD, AND PRINTING APPARATUS RICOH COMPANY, LTD. (JP) 2017-09-21 US disclosed