SCHEMBL21243768

SCHEMBL21243768

CC(C)(C)OC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACE P12821 2/20 0.58
PTPN1 P18031 1/20 0.55
ITGB3 P05106 2/20 0.52
ITGA2B P08514 2/20 0.52
CTSS P25774 10/20 0.51
CTSK P43235 8/20 0.51
CTSB P07858 2/20 0.48
CTSL P07711 1/20 0.48
PPARA Q07869 5/20 0.47
PPARG P37231 4/20 0.47
ITGB1 P05556 1/20 0.46
ITGAV P06756 1/20 0.46
ITGB5 P18084 1/20 0.46
PPARD Q03181 2/20 0.46

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
SCHEMBL1246367 1.00 ACE (0.58) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL1516491 1.00 ACE (0.58) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL5183418 0.93 ACE (0.52) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL16128558 0.91 ACE (0.53) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL20422425 0.91 ACE (0.57) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL21623778 0.91 ACE (0.57) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL20422427 0.91 ACE (0.57) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL22444999 0.88 ACE (0.55) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL16448142 0.88 ACE (0.55) ACEPTPN1ITGB3ITGA2BCTSS
SCHEMBL1448035 0.88 ACE (0.59) ACEPTPN1ITGB3ITGA2BCTSS

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
CN-116874803-A Antibacterial dendritic polyester polymer and preparation method and application thereof 清华大学深圳国际研究生院 2023-10-13 CN claimed
WO-2025201444-A1 NOVEL GSDME INHIBITORS PYROTECH (BEIJING) BIOTECHNOLOGY CO., LTD. (CN) 2025-10-02 WO disclosed
US-20240057599-A1 METHODS FOR IMPROVING FRUIT QUALITY THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2024-02-22 US disclosed
US-20240049709-A1 METHOD OF CONTROLLING FUNGAL INFECTIONS IN PLANTS THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION, (A.R.O), THE VOLCANI INSTITUTE (IL) 2024-02-15 US disclosed
US-11812746-B2 Method of controlling fungal infections in plants THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2023-11-14 US disclosed
CN-116874803-A Antibacterial dendritic polyester polymer and preparation method and application thereof 清华大学深圳国际研究生院 2023-10-13 CN disclosed
US-20200383327-A1 METHOD OF IMPROVING PLANT PERFORMANCE THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCH ORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2020-12-10 US disclosed
US-20190246639-A1 METHOD OF CONTROLLING FUNGAL INFECTIONS IN PLANTS THE STATE OF ISRAEL, MINISTRY OF AGRICULTURE & RURAL DEVELOPMENT, AGRICULTURAL RESEARCHORGANIZATION (ARO) (VOLCANI CENTER) (IL) 2019-08-15 US disclosed