SCHEMBL8568467

SCHEMBL8568467

CCCC[B-](CCCC)(c1ccc(C)cc1)c1ccc(C)cc1.CCCC[P+](CCCC)(CCCC)CCCC

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.40
BDKRB2 P30411 4/20 0.38
HRH3 Q9Y5N1 1/20 0.36
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
KCNH2 Q12809 4/20 0.33
HTT P42858 1/20 0.32
MCHR1 Q99705 1/20 0.32
CCR5 P51681 1/20 0.31
CNR2 P34972 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL8572347 0.93 DNM1 (0.47) DNM1BDKRB2HRH3PTGESALOX5
SCHEMBL8568207 0.93 DNM1 (0.47) DNM1BDKRB2HRH3PTGESALOX5
SCHEMBL8573076 0.89 DNM1 (0.47) DNM1BDKRB2HRH3PTGESALOX5
SCHEMBL8571400 0.87 DNM1 (0.39) DNM1BDKRB2HRH3PTGESALOX5
SCHEMBL8568301 0.87 KCNH2 (0.34) HRH3PTGESALOX5PPARGPPARA
SCHEMBL8573456 0.86 HTT (0.35) HRH3PTGESALOX5PPARGPPARA
SCHEMBL20566136 0.85 DNM1 (0.43) DNM1BDKRB2HRH3PTGESALOX5
SCHEMBL7105924 0.83 DNM1 (0.41) DNM1BDKRB2HRH3PTGESALOX5
SCHEMBL8566280 0.83 DNM1 (0.41) DNM1BDKRB2KCNH2CNR2
Tetramethylammonium Ion SCHEMBL8568845 0.82 HTT (0.35) DNM1KCNH2HTTMCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5814427-A RESIN BINDER, FOR REUSE OF WASTE PAPER BANDO CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-29 US disclosed
EP-0678790-A1 DECOLORABLE TONER AND PRODUCTION METHOD THEREFOR BANDO CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-25 EP disclosed