SCHEMBL28680934

SCHEMBL28680934

CC(C)(C(S)CCC(=O)O)C(S)CCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 6/20 0.50
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRA4 P48169 2/20 0.44
GABRE P78334 2/20 0.44
GABRA6 Q16445 2/20 0.44
GABRG1 Q8N1C3 2/20 0.44
GABRG3 Q99928 2/20 0.44
GABRQ Q9UN88 2/20 0.44
CYP1A2 P05177 2/20 0.44
ANPEP P15144 4/20 0.42
ENPEP Q07075 4/20 0.42

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
SCHEMBL1752169 0.77
SCHEMBL535764 0.77
SCHEMBL1751707 0.77
SCHEMBL28680263 0.76 TSHR (0.48) TET2MEN1TSHRKMT2ASLC1A1
Hydrochloric Acid SCHEMBL7710591 0.75
SCHEMBL29257612 0.72
Ethylene Glycol SCHEMBL1171278 0.71 FOLH1 (0.50) FOLH1GABRPGABRDGABRA1GABRB1
SCHEMBL3082579 0.71 FOLH1 (0.45) FOLH1GABRPGABRDGABRA1GABRB1
SCHEMBL928933 0.71
SCHEMBL27961576 0.71 FOLH1 (0.62) FOLH1GABRPGABRDGABRA1GABRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114377149-B Mn-based degradable MOF nano-reactor and preparation method and application thereof 西北工业大学 2023-11-10 CN claimed
CN-113952468-B Cyclosporin A nano-drug for treating myocardial ischemia reperfusion injury 中国人民解放军空军军医大学 2023-07-07 CN claimed
CN-114377149-A Mn-based degradable MOF nano reactor and preparation method and application thereof 西北工业大学 2022-04-22 CN claimed
CN-113952468-A Cyclosporin A nano-medicine for treating myocardial ischemia reperfusion injury 中国人民解放军空军军医大学 2022-01-21 CN claimed
CN-116196438-B Preparation method of oxidation-responsive nano preparation 武汉科技大学 2024-04-26 CN disclosed
CN-114377149-B Mn-based degradable MOF nano-reactor and preparation method and application thereof 西北工业大学 2023-11-10 CN disclosed
CN-113952468-B Cyclosporin A nano-drug for treating myocardial ischemia reperfusion injury 中国人民解放军空军军医大学 2023-07-07 CN disclosed
CN-116196438-A Preparation method of oxidation-responsive nano preparation 武汉科技大学 2023-06-02 CN disclosed
CN-114870000-A Amphiphilic prodrug for mitochondrion targeted therapy and preparation method and application of nanoparticle thereof 中国人民解放军空军军医大学 2022-08-09 CN disclosed
CN-114377149-A Mn-based degradable MOF nano reactor and preparation method and application thereof 西北工业大学 2022-04-22 CN disclosed
CN-113952468-A Cyclosporin A nano-medicine for treating myocardial ischemia reperfusion injury 中国人民解放军空军军医大学 2022-01-21 CN disclosed