SCHEMBL9769823

SCHEMBL9769823

CC(=O)OC(C(C)=O)n1c(=O)n(CC2CO2)c(=O)n(CC2CO2)c1=O

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.51
HBB P68871 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
DHFR P00374 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL9769829 0.81 TP53 (0.49) TP53HBBSMN1; SMN2DHFR
SCHEMBL10336913 0.76 TP53 (0.50) TP53HBBSMN1; SMN2DHFR
SCHEMBL21944852 0.76 TP53 (0.50) TP53HBBSMN1; SMN2DHFR
SCHEMBL11688183 0.74 TP53 (0.47) TP53HBBSMN1; SMN2ALDH1A1
Teroxirone SCHEMBL31376245 0.74 TP53 (0.95) TP53HBBSMN1; SMN2DHFRALDH1A1
SCHEMBL1715734 0.73 TP53 (0.69) TP53HBBSMN1; SMN2DHFR
Teroxirone SCHEMBL4461477 0.72 TP53 (1.00) TP53HBBSMN1; SMN2DHFRALDH1A1
Teroxirone SCHEMBL4472568 0.72 TP53 (1.00) TP53HBBSMN1; SMN2DHFRALDH1A1
Teroxirone SCHEMBL2097375 0.72 TP53 (1.00) TP53HBBSMN1; SMN2DHFRALDH1A1
Teroxirone SCHEMBL4932 0.72 TP53 (1.00) TP53HBBSMN1; SMN2DHFRALDH1A1

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-4999333-A For facsimile and thermal printing FUJI PHOTO FILM CO., LTD. (JP) 1991-03-12 US disclosed
US-4840888-A SILVER HALIDE GRAINS, METALSALT GRAINS WITH INTERNAL FOG AND P OLYHYDRIC ALCOHOL KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1989-06-20 US disclosed
EP-0269440-A1 Multicolor heat-sensitive recording material Fuji Photo Film Co., Ltd. (JP) 1988-06-01 EP disclosed