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Sugi Predict / Compounds / SCHEMBL22774113

SCHEMBL22774113

SCHEMBL22774113

O=C(OC[C@H]1O[C@H](OC[C@H]2O[C@H](O[C@]3(COC(=O)c4ccccc4)O[C@H](COC(=O)c4ccccc4)[C@@H](OC(=O)c4ccccc4)[C@@H]3OC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.46
▸ PTPN1 P18031 4/20 0.45
▸ USP2 O75604 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ ANTXR2 P58335 3/20 0.40
▸ F11 P03951 2/20 0.40
▸ CA1 P00915 2/20 0.40
▸ CA2 P00918 2/20 0.40
▸ TMPRSS2 O15393 1/20 0.40
▸ PDE5A O76074 1/20 0.40
▸ HMGCR P04035 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ LCK P06239 1/20 0.40
▸ FYN P06241 1/20 0.40
▸ HSPD1 P10809 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CA6 P23280 1/20 0.40
▸ TBXAS1 P24557 1/20 0.40

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
SCHEMBL343136 0.96 MAPT (0.49) MAPTPTPN1USP2MEN1POLB
SCHEMBL14903566 0.96 MAPT (0.49) MAPTPTPN1USP2MEN1POLB
SCHEMBL10310585 0.96 MAPT (0.49) MAPTPTPN1USP2MEN1POLB
SCHEMBL14906687 0.96 MAPT (0.49) MAPTPTPN1USP2MEN1POLB
SCHEMBL10310560 0.96 MAPT (0.49) MAPTPTPN1USP2MEN1POLB
SCHEMBL14679917 0.95 MAPT (0.50) MAPTPTPN1USP2MEN1POLB
SCHEMBL14680922 0.95 MAPT (0.50) MAPTPTPN1USP2MEN1POLB
SCHEMBL22774330 0.93 MAPT (0.41) MAPTPTPN1USP2MEN1POLB
SCHEMBL20724710 0.90 MAPT (0.46) MAPTPTPN1USP2MEN1POLB
SCHEMBL8952353 0.88 PTPN1 (0.43) MAPTPTPN1USP2MEN1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023227517-A1 FORMULATION OF API'S AND EXCIPIENT'S IN AN ICELL VIA HYDROPHOBIC ION PAIRING DANMARKS TEKNISKE UNIVERSITET (DK) 2023-11-30 — — WO claimed
WO-2023227518-A1 POROUS EXPANDING BIOCOMPATIBLE SCAFFOLDS DANMARKS TEKNISKE UNIVERSITET (DK) 2023-11-30 — — WO claimed
WO-2023227548-A1 NUCLEOTIDE DELIVERY FROM INJECTABLE HYDROPHOBIC BIOMATERIAL DANMARKS TEKNISKE UNIVERSITET (DK) 2023-11-30 — — WO disclosed
WO-2023227517-A1 FORMULATION OF API'S AND EXCIPIENT'S IN AN ICELL VIA HYDROPHOBIC ION PAIRING DANMARKS TEKNISKE UNIVERSITET (DK) 2023-11-30 — — WO disclosed
WO-2023227518-A1 POROUS EXPANDING BIOCOMPATIBLE SCAFFOLDS DANMARKS TEKNISKE UNIVERSITET (DK) 2023-11-30 — — WO disclosed
EP-4282435-A1 FORMULATIONS OF ACTIVE PHARMACEUTICAL INGREDIENTS AND EXCIPIENTS IN ICELLS VIA HYDROPHOBIC ION PAIRING Danmarks Tekniske Universitet (DK) 2023-11-29 — — EP disclosed
EP-3982922-A1 DISSACHARIDE FORMULATIONS FOR CONTROLLED DRUG RELEASE Technical University of Denmark (DK) 2022-04-20 — — EP disclosed
WO-2020249801-A1 DISSACHARIDE FORMULATIONS FOR CONTROLLED DRUG RELEASE TECHNICAL UNIVERSITY OF DENMARK (DK) 2020-12-17 — — WO disclosed
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