SCHEMBL9178335

SCHEMBL9178335

NCc1c(CC2CO2)c(CC2CO2)c(CN)c(CC2CO2)c1CC1CO1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TP53 P04637 1/20 0.32
HBB P68871 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL912784 1.00 ALDH1A1 (0.33) ALDH1A1TDP1TP53HBBSMN1; SMN2
SCHEMBL686767 1.00 ALDH1A1 (0.33) ALDH1A1TDP1TP53HBBSMN1; SMN2
SCHEMBL8026352 0.79 ALDH1A1 (0.33) ALDH1A1TDP1TP53HBBSMN1; SMN2
SCHEMBL18428573 0.78 MEN1 (0.42) TDP1SMN1; SMN2
SCHEMBL6924763 0.77 ALDH1A1 (0.32) ALDH1A1TDP1TP53HBBSMN1; SMN2
SCHEMBL30490439 0.77
SCHEMBL132722 0.76 ALDH1A1 (0.35) ALDH1A1TDP1TP53HBBSMN1; SMN2
SCHEMBL30865852 0.74 ALDH1A1 (0.33) ALDH1A1TDP1TP53HBBSMN1; SMN2
SCHEMBL6678130 0.73 PNMT (0.38) ALDH1A1TDP1TP53SMN1; SMN2
SCHEMBL21114057 0.72 ALDH1A1 (0.32) ALDH1A1TDP1TP53HBBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111187395-B Epoxy resin composition, fiber-reinforced composite material, molded article, and pressure vessel 东丽株式会社 2022-11-22 CN disclosed
CN-111138634-B Epoxy resin composition, fiber-reinforced composite material, molded article, and pressure vessel 东丽株式会社 2022-11-22 CN disclosed
CN-110546560-B Liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2022-08-19 CN disclosed
EP-0542512-B1 Oxygen-scavenging composition MITSUBISHI GAS CHEMICAL CO (JP) 1995-07-26 EP disclosed
US-5387368-A A mixture of an aryl diamine, a transition metal compound and a phosphorus compound; prevents oxidation and decay of organic MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-02-07 US disclosed
EP-0542512-A1 Oxygen-scavenging composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1993-05-19 EP disclosed
EP-0492562-A2 Plural liquid pack type heat curable polyisocyanate-glycidyl acrylate compound resinous composition and process for producing shaped resin article therefrom TEIJIN LIMITED (JP) 1992-07-01 EP disclosed