SCHEMBL6608708

SCHEMBL6608708

CC(C)C(NC(C)(C)C)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.37
ALDH1A1 P00352 2/20 0.37
CA12 O43570 1/20 0.35
CA14 Q9ULX7 1/20 0.35
LMNA P02545 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
PLA2G2A P14555 1/20 0.35
PLA2G5 P39877 1/20 0.35
TP53 P04637 1/20 0.35
SLC7A5 Q01650 1/20 0.35
KDM4E B2RXH2 1/20 0.34
FPR2 P25090 1/20 0.34
MMP2 P08253 4/20 0.33
MMP3 P08254 4/20 0.33
MMP13 P45452 4/20 0.33
MMP1 P03956 3/20 0.33
MMP7 P09237 3/20 0.33
MMP9 P14780 3/20 0.33
ADAMTS4 O75173 1/20 0.33

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
SCHEMBL17245263 1.00 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1CA12CA14LMNA
SCHEMBL6608711 1.00 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1CA12CA14LMNA
Hydrochloric Acid SCHEMBL626518 0.98 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1CA12CA14LMNA
Hydrochloric Acid SCHEMBL626519 0.98 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1CA12CA14LMNA
SCHEMBL15922140 0.87 ALDH1A1 (0.35) ALDH1A1TP53SLC6A3
SCHEMBL17169784 0.83 TP53 (0.39) ALDH1A1TP53SLC6A3
SCHEMBL3891997 0.83 TP53 (0.39) ALDH1A1TP53SLC6A3
SCHEMBL3272882 0.83 TP53 (0.39) ALDH1A1TP53SLC6A3
SCHEMBL3272876 0.83 TP53 (0.39) ALDH1A1TP53SLC6A3
Hydrochloric Acid SCHEMBL3653512 0.81 TP53 (0.38) SMN1; SMN2ALDH1A1TP53SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN claimed
CN-109928908-B Preparation method and intermediate of drug-linker MC-MMAF for antibody drug conjugate 联宁(苏州)生物制药有限公司 2022-05-03 CN claimed
CN-119470406-A Phthalic dicarboxaldehyde disinfectant concentration detection test paper and preparation method thereof 山东新华莎罗雅生物技术有限公司 2025-02-18 CN disclosed
CN-118239879-A Method for preparing 3-substituted oxindole, dihydroisoindigo and tetra-substituted ethane based on primary amine and application of primary amine 泰山学院 2024-06-25 CN disclosed
US-20220183291-A1 COMPOSITIONS AND METHODS FOR MODULATING IMMUNITY IN PLANTS BOYCE THOMPSON INSTITUTE FOR PLANT RESEARCH, INC. 2022-06-16 US disclosed
CN-114466838-A Nitrile-containing antiviral compounds 辉瑞大药厂 2022-05-10 CN disclosed
CN-113924290-A Thiohydrazinocarboxylic acid esters and their use 范因斯坦医学研究院 2022-01-11 CN disclosed
CN-113816990-A Modified amino acids and their use in ADCs 联宁(苏州)生物制药有限公司 2021-12-21 CN disclosed
CN-112543764-A Amide compound with BET proteolysis induction effect and medical application thereof 田边三菱制药株式会社 2021-03-23 CN disclosed
WO-2020242253-A1 NOVEL EMPAGLIFLOZIN DERIVATIVE WHICH IS SGLT-2 INHIBITOR 동아에스티 주식회사 2020-12-03 WO disclosed
CN-106316982-B Thiazine amide derivative and use thereof 中国人民解放军军事医学科学院毒物药物研究所 2020-08-14 CN disclosed
US-20030176445-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. 2003-09-18 US disclosed
EP-1106615-B1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER (US) 2003-03-05 EP disclosed
US-6444677-B2 TREATMENT OF INFLAMMATION, CARDIOVASCULAR DISEASE, PAIN, ETC. PFIZER INC. 2002-09-03 US disclosed
US-20020042421-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists OKUMURA YOSHIYUKI (JP) 2002-04-11 US disclosed
US-20010046993-A1 5-memberd heteroaryl substituted 1,4-dihydropyridine compounds as bradykinin antagonists IKEDA TAKAFUMI (JP) 2001-11-29 US disclosed
EP-1106614-A1 5-Membered heteroaryl substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. (US) 2001-06-13 EP disclosed
EP-1106615-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. (US) 2001-06-13 EP disclosed
US-6156752-A Optically active 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC (US) 2000-12-05 US disclosed
EP-0899261-A1 Optical active 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. (US) 1999-03-03 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-20220183291-A1 COMPOSITIONS AND METHODS FOR MODULATING IMMUNITY IN PLANTS IFNG, STING1, IRF3 SMN1; SMN2 4468/4885ALDH1A1 4576/4885CA12 3643/4885
US-20030176445-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 SMN1; SMN2 4652/4885ALDH1A1 2124/4885CA12 3085/4885
US-20010046993-A1 5-memberd heteroaryl substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, CNR2 SMN1; SMN2 3038/4885ALDH1A1 2557/4885CA12 4513/4885
US-20020042421-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 SMN1; SMN2 4681/4885ALDH1A1 1413/4885CA12 3286/4885

“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.