SCHEMBL6691152

SCHEMBL6691152

C=C(CCCC[N+](C)(C)CC)C(=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 9/20 0.58
DNM1 Q05193 2/20 0.42
KMT2A Q03164 2/20 0.42
HTT P42858 1/20 0.42
HSP90AA1 P07900 1/20 0.41
RAD52 P43351 1/20 0.41
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
GRK2 P25098 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL3210702 0.94 BBOX1 (0.66) BBOX1DNM1KMT2AHTTHSP90AA1
SCHEMBL4972961 0.86 BBOX1 (0.53) BBOX1DNM1KMT2AHTTHSP90AA1
Hydrochloric Acid SCHEMBL28423461 0.84 HTT (0.50) DNM1KMT2AHTTHSP90AA1RAD52
SCHEMBL15397899 0.82 ACHE (0.45) BBOX1DNM1KMT2AMEN1LMNA
SCHEMBL612764 0.81 APOBEC3A (0.44) DNM1KMT2AHSP90AA1RAD52MEN1
SCHEMBL16824231 0.79 HTT (0.52) BBOX1DNM1KMT2AHTTHSP90AA1
SCHEMBL16824204 0.79 HTT (0.52) BBOX1DNM1KMT2AHTTHSP90AA1
SCHEMBL18044444 0.77 BBOX1 (0.57) BBOX1DNM1KMT2AHTTHSP90AA1
SCHEMBL170245 0.76 ACHE (0.52) BBOX1KMT2AMEN1LMNA
Potassium Ion SCHEMBL4019143 0.76 CES2 (0.56) KMT2AMEN1

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
WO-2004056896-A1 POLYMERS CONTAINING CATIONIC MACROMONOMERS, AND THEIR USE IN COSMETIC PREPARATIONS BASF AKTIENGESELLSCHAFT (DE) 2004-07-08 WO disclosed