SCHEMBL9691206

SCHEMBL9691206

CCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.68
HTT P42858 2/20 0.60
DNM1 Q05193 8/20 0.58
KMT2A Q03164 1/20 0.50
HSP90AA1 P07900 1/20 0.48
RAD52 P43351 1/20 0.48

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
SCHEMBL10933662 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL61438 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL61124 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL10936179 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL61326 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL10937740 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL61271 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL10975952 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL60617 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1
SCHEMBL62048 1.00 BBOX1 (0.68) BBOX1HTTDNM1KMT2AHSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0188450-B1 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES DIAGNOSTIC RESEARCH LIMITED PARTNERSHIP (US) 1992-08-12 EP claimed
EP-0188450-A4 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES. DIAGNOSTIC RES LTD (US) 1989-02-02 EP claimed
US-4652517-A Methods for the in vitro detection and identification of unknown pathogens or genetic entities DIAGNOSTIC RESEARCH LIMITED PARTNERSHIP (US) 1987-03-24 US claimed
EP-0188450-A1 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES. DIAGNOSTIC RESEARCH LIMITED PA (US) 1986-07-30 EP claimed
WO-1986000139-A1 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES DIAGNOSTIC RESEARCH LIMITED PARTNERSHIP (US) 1986-01-03 WO claimed
EP-0188450-B1 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES DIAGNOSTIC RESEARCH LIMITED PARTNERSHIP (US) 1992-08-12 EP disclosed
EP-0308239-A2 Method for reducing bacterial endotoxin contamination in solutions of macromolecules SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1989-03-22 EP disclosed
US-4808314-A MIXING WITH SURFACTANT, ABSORPTION, SEPARATION SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1989-02-28 US disclosed
EP-0188450-A4 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES. DIAGNOSTIC RES LTD (US) 1989-02-02 EP disclosed
US-4652517-A Methods for the in vitro detection and identification of unknown pathogens or genetic entities DIAGNOSTIC RESEARCH LIMITED PARTNERSHIP (US) 1987-03-24 US disclosed
EP-0188450-A1 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES. DIAGNOSTIC RESEARCH LIMITED PA (US) 1986-07-30 EP disclosed
WO-1986000139-A1 METHODS FOR THE IN VITRO DETECTION AND IDENTIFICATION OF UNKNOWN PATHOGENS OR GENETIC ENTITIES DIAGNOSTIC RESEARCH LIMITED PARTNERSHIP (US) 1986-01-03 WO disclosed