SCHEMBL19360451

SCHEMBL19360451

C=C(C)C(=O)OCCCCCCCCCCOC(=O)c1ccc2ccccc2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.56
HTT P42858 2/20 0.56
POLB P06746 1/20 0.56
APEX1 P27695 1/20 0.56
HRH3 Q9Y5N1 2/20 0.56
DRD3 P35462 1/20 0.56
TSHR P16473 2/20 0.48
HDAC6 Q9UBN7 2/20 0.46
ADRB2 P07550 1/20 0.45
ADRB1 P08588 1/20 0.45
ADRB3 P13945 1/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42

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
SCHEMBL19360453 1.00 TDP1 (0.56) TDP1HTTPOLBAPEX1HRH3
SCHEMBL9880800 0.93 HRH3 (0.55) TDP1HTTPOLBAPEX1HRH3
SCHEMBL16772618 0.92 TDP1 (0.51) TDP1HTTPOLBAPEX1HRH3
SCHEMBL17445708 0.90 HRH3 (0.50) TDP1HTTPOLBAPEX1HRH3
SCHEMBL17445712 0.90 HRH3 (0.50) TDP1HTTPOLBAPEX1HRH3
SCHEMBL17445711 0.90 HRH3 (0.50) TDP1HTTPOLBAPEX1HRH3
SCHEMBL19360464 0.90 HRH3 (0.52) TDP1HTTPOLBAPEX1HRH3
SCHEMBL19360462 0.90 HRH3 (0.52) TDP1HTTPOLBAPEX1HRH3
SCHEMBL13609723 0.89 HRH3 (0.51) TDP1HTTPOLBAPEX1HRH3
SCHEMBL18926598 0.88 HTT (0.48) TDP1HTTPOLBAPEX1HRH3

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