SCHEMBL5597410

SCHEMBL5597410

O=C(O)ON1CCCCC1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.38
CYP1A2 P05177 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 3/20 0.32
POLB P06746 2/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
MMP9 P14780 1/20 0.32
GAA P10253 1/20 0.31
CA2 P00918 1/20 0.31
CHKA P35790 1/20 0.31
MAPT P10636 1/20 0.31
DPP7 Q9UHL4 1/20 0.30
HTT P42858 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL15414871 1.00 ALDH1A1 (0.38) ALDH1A1CYP1A2MAPK1SMN1; SMN2HPGD
SCHEMBL2576954 0.97
SCHEMBL18124347 0.89 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9184856 0.85
Azepane SCHEMBL15135390 0.85 CA2 (0.41) ALDH1A1CA2CHKA
SCHEMBL28844421 0.82
SCHEMBL5855885 0.81 ALDH1A1 (0.36) ALDH1A1CYP1A2MAPK1SMN1; SMN2HPGD
SCHEMBL5597409 0.80 HPGD (0.32) ALDH1A1HPGD
SCHEMBL2483464 0.80 ALDH1A1 (0.39) ALDH1A1CYP1A2MAPK1SMN1; SMN2HPGD
SCHEMBL1114107 0.80 ALDH1A1 (0.39) ALDH1A1CYP1A2MAPK1SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007081530-A2 ENDOLUMINAL MEDICAL DEVICE FOR LOCAL DELIVERY OF CATHEPSIN INHIBITORS MED INSTITUTE, INC. (US) 2007-07-19 WO claimed
US-6380220-B1 THERAPY OF NEURODEGENERATIVE DISEASES AND NEURONAL INJURIES WHICH ARE CASUED BY ISCHEMIA, TRAUMA OR MASSIVE HEMORRHAGES ABBOTT LABORATORIES 2002-04-30 US claimed
US-6046261-A STABILIZER FOR ORGANIC MATERIAL HAVING EXCELLENT BLOOMING RESISTANCE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-04-04 US claimed
JP-11060556-A None JP disclosed
JP-1193361-A None JP disclosed
CN-109867676-A Compound derived from a kind of pyrrolopyrimidine, pharmaceutical composition with and application thereof 北京普祺医药科技有限公司 2019-06-11 CN disclosed
CN-106458969-A (substituted phenyl) (substituted pyrimidine) amino derivative and preparation method and pharmaceutical application thereof 四川海思科制药有限公司 2017-02-22 CN disclosed
EP-2852573-B1 N-[3-(2-CARBOXYETHYL)PHENYL]-PIPERIDIN-1-YL ACETAMIDE DERIVATIVES AND THEIR USE AS ACTIVATORS OF SOLUBLE GUANYLATE CYCLASE Bayer Pharma AG (DE) 2017-02-01 EP disclosed
CN-105518001-A MODIFIED BET-PROTEIN-INHIBITING DIHYDROQUINOXALINONES AND DIHYDROPYRIDOPYRAZINONES Bayer Pharma AG 2016-04-20 CN disclosed
CN-105384694-A Substituted aminopyrimidine derivative, preparation method therefor and pharmaceutical application thereof SICHUAN HAISCO PHARMACEUTICAL CO LTD 2016-03-09 CN disclosed
CN-104844566-A Kinase inhibitor with novel structure HEFEI INST PHYSICAL SCI CAS 2015-08-19 CN disclosed
US-20070293937-A1 Endoluminal medical device for local delivery of cathepsin inhibitors, method of making and treating MED INSTITUTE, INC. 2007-12-20 US disclosed
WO-2007081530-A2 ENDOLUMINAL MEDICAL DEVICE FOR LOCAL DELIVERY OF CATHEPSIN INHIBITORS MED INSTITUTE, INC. (US) 2007-07-19 WO disclosed
US-6380220-B1 THERAPY OF NEURODEGENERATIVE DISEASES AND NEURONAL INJURIES WHICH ARE CASUED BY ISCHEMIA, TRAUMA OR MASSIVE HEMORRHAGES ABBOTT LABORATORIES 2002-04-30 US disclosed
US-6380220-B1 THERAPY OF NEURODEGENERATIVE DISEASES AND NEURONAL INJURIES WHICH ARE CASUED BY ISCHEMIA, TRAUMA OR MASSIVE HEMORRHAGES ABBOTT LABORATORIES 2002-04-30 US disclosed
US-6046261-A STABILIZER FOR ORGANIC MATERIAL HAVING EXCELLENT BLOOMING RESISTANCE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-04-04 US disclosed
CN-1239950-A New derivates from piperidine-keto acid, their preparation and use BASF AG (DE) 1999-12-29 CN disclosed
JP-H1160556-A PIPERIDINE-BASED COMPOUND, ITS PRODUCTION AND USE THEREOF SUMITOMO CHEM CO LTD 1999-03-02 JP disclosed
EP-0332761-A2 Single-functional and mixtures of multifunctional oligomeric performance additive compositions, and their use ELF ATOCHEM NORTH AMERICA, INC. (US) 1989-09-20 EP disclosed
JP-H01193361-A STABILIZED SYNTHETIC RESIN COMPOSITION ADEKA ARGUS CHEM CO LTD 1989-08-03 JP 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-20070293937-A1 Endoluminal medical device for local delivery of cathepsin inhibitors, method of making and treating CTSS, CTSD, CTSV ALDH1A1 3476/4885CYP1A2 3934/4885MAPK1 4174/4885

“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.