SCHEMBL453228

SCHEMBL453228

CCCOC(=O)C1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.51
PTPN1 P18031 1/20 0.51
PPP1CC P36873 1/20 0.51
ALDH1A1 P00352 3/20 0.50
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL148328 0.98 ALDH1A1 (0.53) PPM1BPTPN1PPP1CCALDH1A1ADRB2
SCHEMBL8631955 0.98 ALDH1A1 (0.53) PPM1BPTPN1PPP1CCALDH1A1ADRB2
SCHEMBL8695709 0.96 PPM1B (0.51) PPM1BPTPN1PPP1CCALDH1A1ADRB2
SCHEMBL29104424 0.92 ALDH1A1 (0.61) PPM1BPTPN1PPP1CCALDH1A1MEN1
SCHEMBL1245712 0.92 PPM1B (0.45) PPM1BPTPN1PPP1CCALDH1A1ADRB2
SCHEMBL526510 0.91 PPM1B (0.55) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL6141464 0.91
SCHEMBL187699 0.88 ALDH1A1 (0.48) PPM1BPTPN1PPP1CCALDH1A1ADRB2
SCHEMBL1246326 0.88 EPHX2 (0.46) PPM1BPTPN1PPP1CCALDH1A1ADRB2
SCHEMBL7907216 0.88 EPHX2 (0.46) PPM1BPTPN1PPP1CCALDH1A1ADRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018088-A1 SEPARATION AND PURIFICATION METHOD OF 2-NITROETHANOL FUDAN UNIVERSITY (CN) 2024-01-18 US claimed
CN-116410093-A Separation and purification method of 2-nitroethanol 复旦大学 2023-07-11 CN claimed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US claimed
US-20240131180-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2024-04-25 US disclosed
EP-4025253-B1 DRUG ANTIBODY CONJUGATES PHARMA MAR SA (ES) 2024-03-20 EP disclosed
CN-114615999-B Drug antibody conjugates 法马马有限公司 2024-03-08 CN disclosed
US-20240018088-A1 SEPARATION AND PURIFICATION METHOD OF 2-NITROETHANOL FUDAN UNIVERSITY (CN) 2024-01-18 US disclosed
US-20230268178-A1 PROTECTIVE COMPOSITION AND METHOD OF FORMING PHOTORESIST PATTERN TAIWAN SEMICONDUCTOR MANUFACTURING CO., LTD. (TW) 2023-08-24 US disclosed
US-20230218774-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2023-07-13 US disclosed
US-20230150941-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2023-05-18 US disclosed
EP-4138923-A1 DRUG ANTIBODY CONJUGATES Pharma Mar, S.A. (ES) 2023-03-01 EP disclosed
EP-0437016-A2 Lipid A analogues having immunoactivating and anti-tumour activity Sankyo Company Limited (JP) 1991-07-17 EP disclosed
EP-0363223-A2 3-Aryloxymethyl-cephalosporin derivatives, their preparation and their medical use Sankyo Company Limited (JP) 1990-04-11 EP disclosed
EP-0337637-A1 2-(Heterocyclylthio)carbapenem derivatives their preparation and their use as antibiotics Sankyo Company Limited (JP) 1989-10-18 EP disclosed
US-4748172-A 3-bicyclicpyridinium-methyl cephalosporins ELI LILLY AND COMPANY (US) 1988-05-31 US disclosed
US-4692443-A 3-bicyclicpyridinium-methyl cephalosporins ELI LILLY AND COMPANY (US) 1987-09-08 US disclosed
US-4577014-A ANTIBIOTICS ELI LILLY AND COMPANY (US) 1986-03-18 US disclosed
EP-0138552-A2 Improvements on or relating to 3-bicyclicpyridinium-methyl cephalosporins ELI LILLY AND COMPANY (US) 1985-04-24 EP disclosed
US-4501739-A BACTERICIDES, ANTIBIOTICS ELI LILLY AND COMPANY (US) 1985-02-26 US disclosed
EP-0074268-A2 Improvements in or relating to thieno and furopyridinium-substituted cephalosporin derivatives ELI LILLY AND COMPANY (US) 1983-03-16 EP 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 (4 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-20240131180-A1 DRUG ANTIBODY CONJUGATES STT3B, STT3A, TTL PPM1B 4115/4885PTPN1 1588/4885PPP1CC 4057/4885
US-20240018088-A1 SEPARATION AND PURIFICATION METHOD OF 2-NITROETHANOL NUCB2, DNPH1, ECE2 PPM1B 975/4885PTPN1 3592/4885PPP1CC 1237/4885
US-20230150941-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHOLOGICAL DISORDERS GABBR1, GABBR2, GABRE PPM1B 683/4885PTPN1 4536/4885PPP1CC 1531/4885
US-20230218774-A1 DRUG ANTIBODY CONJUGATES B3GAT3, MGAT3, SDAD1 PPM1B 3539/4885PTPN1 925/4885PPP1CC 4494/4885

“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.