SCHEMBL489809

SCHEMBL489809

CCCCN(C=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
ESR1 P03372 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
NPC1 O15118 1/20 0.42
JAK2 O60674 1/20 0.42
RAB9A P51151 1/20 0.42
PAX8 Q06710 1/20 0.42
TP53 P04637 1/20 0.42
HDAC6 Q9UBN7 1/20 0.41
KCNH2 Q12809 1/20 0.40
CASP1 P29466 1/20 0.40
BRCA1 P38398 1/20 0.40
CASP7 P55210 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALOX15 P16050 1/20 0.40
GAA P10253 1/20 0.39
HPGD P15428 1/20 0.39

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
Chloromethane SCHEMBL7281088 0.96 NPC1 (0.44) TDP1ESR1MEN1KMT2ANPSR1
SCHEMBL704307 0.94 NPC1 (0.49) TDP1ESR1MEN1KMT2ANPSR1
SCHEMBL16414653 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL16415141 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL7651322 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL16415177 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL707050 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL3458582 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL1685969 0.92 NPC1 (0.51) TDP1NPC1JAK2RAB9APAX8
SCHEMBL709444 0.88 TP53 (0.44) TDP1ESR1MEN1KMT2ANPC1

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 166 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230224-B1 PROCESS FOR THE PREPARATION OF ALCOXYCARBONYL ISOCYANATES BAYER AG (DE) 1991-07-17 EP claimed
US-4777283-A Process for the preparation of alkoxycarbonyl isocyanates BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US claimed
EP-0230224-A2 Process for the preparation of alcoxycarbonyl isocyanates BAYER AG (DE) 1987-07-29 EP claimed
US-11886119-B2 Material for forming underlayer film, resist underlayer film, method of producing resist underlayer film, and laminate MITSUI CHEMICALS, INC. (JP) 2024-01-30 US disclosed
US-20230374355-A1 ADHESIVE COMPOSITION, DIE ATTACH MATERIAL, SEALING AGENT OR COATING AGENT FOR PROTECTION, AND ELECTRICAL/ELECTRONIC COMPONENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-11-23 US disclosed
US-20230185195-A1 MATERIAL FOR FORMING UNDERLAYER FILM, RESIST UNDERLAYER FILM, METHOD OF PRODUCING RESIST UNDERLAYER FILM, AND LAMINATE MITSUI CHEMICALS, INC. (JP) 2023-06-15 US disclosed
CN-115894536-A Dipyrromethene boron complex compounds, colored compositions and optical filters containing the same 保土谷化学工业株式会社 2023-04-04 CN disclosed
US-11599025-B2 Resin material for forming underlayer film, resist underlayer film, method of producing resist underlayer film, and laminate MITSUI CHEMICALS, INC. (JP) 2023-03-07 US disclosed
US-20230013430-A1 SULFONIUM SALT, ACID GENERATOR, RESIST COMPOSITION, AND METHOD FOR PRODUCING DEVICE TOYO GOSEI CO., LTD. (JP) 2023-01-19 US disclosed
US-20220050379-A1 MATERIAL FOR FORMING UNDERLAYER FILM, RESIST UNDERLAYER FILM, AND LAMINATE MITSUI CHEMICALS, INC. (JP) 2022-02-17 US disclosed
EP-3922456-A1 MATERIAL FOR UNDERLAYER FILM FORMATION USE, RESIST UNDERLAYER FILM, AND LAMINATE Mitsui Chemicals, Inc. (JP) 2021-12-15 EP disclosed
EP-0230224-B1 PROCESS FOR THE PREPARATION OF ALCOXYCARBONYL ISOCYANATES BAYER AG (DE) 1991-07-17 EP disclosed
US-4777283-A Process for the preparation of alkoxycarbonyl isocyanates BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US disclosed
US-4741980-A Method for increasing color-fastness of organic coloring matter KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1988-05-03 US disclosed
US-4713389-A Fungicidally and bactericidally active acylated saccharin derivatives BAYER AKTIENGESELLSCHAFT (DE) 1987-12-15 US disclosed
EP-0230224-A2 Process for the preparation of alcoxycarbonyl isocyanates BAYER AG (DE) 1987-07-29 EP disclosed
EP-0216598-A2 Method for increasing color-fastness of organic coloring matter KONICA CORPORATION (JP) 1987-04-01 EP disclosed
EP-0172789-A2 Process for the sulfation of compounds containing a hydroxyethyl group CIBA-GEIGY AG (CH) 1986-02-26 EP disclosed
US-4191576-A SULFONYL-SUBSTITUTED PYRROLIDINE, OXAZOLIDINE OR THIAZOLIDINE FUJI PHOTO FILM CO., LTD. (JP) 1980-03-04 US disclosed
US-4157333-A CONDENSATION OF 1,2-METHYLENEDIOXYBENZENE WITH N-ALKYLOORMANILIDE, HYDROLYSIS MITSUI TOATSU CHEMICALS, INC. (JP) 1979-06-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230013430-A1 SULFONIUM SALT, ACID GENERATOR, RESIST COMPOSITION, AND METHOD FOR PRODUCING DEVICE ARSA, SULT1A1, RER1 TDP1 3800/4885ESR1 386/4885MEN1 1141/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.