SCHEMBL16900271

SCHEMBL16900271

C=C(c1ccccc1)c1ccc(OCCCCn2c3ccccc3c3ccccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.50
PLA2G2A P14555 2/20 0.48
FABP4 P15090 2/20 0.48
FABP5 Q01469 2/20 0.48
KCNA3 P22001 2/20 0.47
CNR2 P34972 1/20 0.46
PSEN1 P49768 4/20 0.46
PSEN2 P49810 4/20 0.46
APH1B Q8WW43 4/20 0.46
NCSTN Q92542 4/20 0.46
APH1A Q96BI3 4/20 0.46
PSENEN Q9NZ42 4/20 0.46
HRH4 Q9H3N8 1/20 0.45
PSMB1 P20618 1/20 0.45
PSMB5 P28074 1/20 0.45
PSMB2 P49721 1/20 0.45
PPARA Q07869 2/20 0.44
PPARG P37231 1/20 0.44
PPARD Q03181 1/20 0.44
KDM4E B2RXH2 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
SCHEMBL16900464 0.99 PLA2G2A (0.50) ACHEPLA2G2AFABP4FABP5KCNA3
SCHEMBL4154401 0.85 HRH4 (0.63) ACHEPLA2G2AFABP4FABP5CNR2
SCHEMBL4154432 0.85 PLA2G2A (0.63) ACHEPLA2G2AFABP4FABP5KCNA3
SCHEMBL4730270 0.79 SMN1; SMN2 (0.56) FABP4FABP5KCNA3ALDH1A1MEN1
SCHEMBL4155967 0.79 MAPT (0.59) ACHEPLA2G2AFABP4FABP5KCNA3
SCHEMBL14366323 0.77 PKM (0.56) KCNA3PSMB1PSMB5PSMB2PPARA
SCHEMBL351636 0.76 FABP4 (0.55) ACHEPLA2G2AFABP4FABP5KCNA3
SCHEMBL17589881 0.75 GAA (0.54) ACHEKCNA3HRH4PSMB1PSMB5
SCHEMBL19559314 0.75 MAPT (0.61) ACHEPLA2G2AFABP4FABP5CNR2
SCHEMBL31433127 0.73 HRH3 (0.52) PSEN1PSEN2APH1BNCSTNAPH1A

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-9079999-B2 Methods for preparing polymer coatings by electrochemical grafting of polymer brushes, compositions prepared thereby and compositions for preparing the coatings ADVINCULA RIGOBERTO (US) 2015-07-14 US disclosed
US-9079999-B2 Methods for preparing polymer coatings by electrochemical grafting of polymer brushes, compositions prepared thereby and compositions for preparing the coatings ADVINCULA RIGOBERTO (US) 2015-07-14 US disclosed