SCHEMBL6202528

SCHEMBL6202528

CCCOc1c2cccc1Cc1cccc(c1)Cc1cccc(c1OCCC)Cc1cccc(c1)C2

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 4/20 0.53
PTPN2 P17706 4/20 0.53
PTPN1 P18031 4/20 0.53
PTPRB P23467 4/20 0.53
PTPN11 Q06124 4/20 0.53
GSTA1 P08263 6/20 0.50
GSTP1 P09211 6/20 0.50
TLR4 O00206 5/20 0.48
CD14 P08571 4/20 0.48
LY96 Q9Y6Y9 4/20 0.48
CD69 Q07108 2/20 0.45
KMT2A Q03164 1/20 0.36
LGALS1 P09382 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL757636 0.90 GSTA1 (0.50) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL759676 0.87 GSTA1 (0.52) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL31326111 0.87 GSTA1 (0.56) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL12856857 0.87 GSTA1 (0.56) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL6820489 0.85 PTPRC (0.46) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL5021866 0.79 GSTA1 (0.51) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL12856732 0.79 GSTA1 (0.67) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL30702676 0.77 GSTA1 (0.57) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL6067606 0.77 GSTA1 (0.57) PTPRCPTPN2PTPN1PTPRBPTPN11
SCHEMBL19726834 0.76 GSTA1 (0.64) PTPRCPTPN2PTPN1PTPRBPTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021217175-A1 IONOMERS WITH MACROCYCLIC MOIETIES FOR ION CONDUCTIVITY AND PERMSELECTIVITY NUTECH VENTURES (US) 2021-10-28 WO disclosed
EP-1468274-A4 POTASSIUM FLUOROIONOPHORE BAYER AG (US) 2005-04-20 EP disclosed
EP-1468274-A1 POTASSIUM FLUOROIONOPHORE Bayer Corporation (US) 2004-10-20 EP disclosed
WO-2003056310-A1 POTASSIUM FLUOROIONOPHORE BAYER CORPORATION (US) 2003-07-10 WO disclosed