SCHEMBL9691972

SCHEMBL9691972

CCCCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)O.CCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)O

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.60
DNM1 Q05193 9/20 0.58
KMT2A Q03164 1/20 0.50
HSP90AA1 P07900 2/20 0.48
RAD52 P43351 2/20 0.48
PLA2G1B P04054 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45
ENPP2 Q13822 3/20 0.45
LMNA P02545 1/20 0.43

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
SCHEMBL61439 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL10933953 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL10932296 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL61125 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL6236479 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL10937742 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL60618 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL10975956 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL16604562 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL61327 1.00 HTT (0.60) HTTDNM1KMT2AHSP90AA1RAD52

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 1 patent. 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