SCHEMBL1899569

SCHEMBL1899569

CCCCCCOc1cc(I)c(OCCCCCC)cc1I

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
ESR1 P03372 1/20 0.46
PTPN11 Q06124 3/20 0.43
S1PR3 Q99500 1/20 0.43
TLR8 Q9NR97 1/20 0.42
NR5A1 Q13285 1/20 0.42
MEN1 O00255 1/20 0.42
NR1I2 O75469 1/20 0.42
LMNA P02545 1/20 0.42
CHRM2 P08172 1/20 0.42
CYP3A4 P08684 1/20 0.42
ADRA2A P08913 1/20 0.42
MAPT P10636 1/20 0.42
OPRK1 P41145 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A3 Q01959 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
PLA2G2A P14555 1/20 0.42

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
SCHEMBL766731 1.00 THRA (0.49) THRATHRBESR1PTPN11S1PR3
SCHEMBL13400876 1.00 THRA (0.49) THRATHRBESR1PTPN11S1PR3
SCHEMBL1778304 1.00 THRA (0.49) THRATHRBESR1PTPN11S1PR3
SCHEMBL1776059 1.00 THRA (0.49) THRATHRBESR1PTPN11S1PR3
SCHEMBL2831022 1.00 THRA (0.49) THRATHRBESR1PTPN11S1PR3
SCHEMBL14029780 0.92 SMPD1 (0.46) THRATHRBESR1LMNACYP3A4
SCHEMBL9556471 0.91 CYP1A2 (0.45) THRATHRBESR1TLR8MEN1
SCHEMBL13171441 0.91 THRA (0.44) THRATHRBESR1PTPN11S1PR3
SCHEMBL3338651 0.91 THRA (0.44) THRATHRBESR1PTPN11S1PR3
SCHEMBL15135019 0.89 ESR1 (0.46) THRATHRBESR1PTPN11S1PR3

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8562867-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2013-10-22 US disclosed
US-8562867-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2013-10-22 US disclosed
EP-1537187-B1 ORGANIC SPECIES THAT FACILITATE CHARGE TRANSFER TO OR FROM NANOSTRUCTURES NANOSYS INC (US) 2012-08-15 EP disclosed
EP-1537187-B1 ORGANIC SPECIES THAT FACILITATE CHARGE TRANSFER TO OR FROM NANOSTRUCTURES NANOSYS INC (US) 2012-08-15 EP disclosed
US-7943064-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2011-05-17 US disclosed
US-7943064-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2011-05-17 US disclosed
US-20100065783-A1 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2010-03-18 US disclosed
US-20100065783-A1 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2010-03-18 US disclosed
US-7572395-B2 Addition polymer modified with amine, mercaptan, phosphorus compound or acid compound NANOSYS, INC (US) 2009-08-11 US disclosed
US-7572395-B2 Addition polymer modified with amine, mercaptan, phosphorus compound or acid compound NANOSYS, INC (US) 2009-08-11 US disclosed
US-7438833-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2008-10-21 US disclosed
US-7438833-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2008-10-21 US disclosed
EP-1537187-A4 ORGANIC SPECIES THAT FACILITATE CHARGE TRANSFER TO OR FROM NANOSTRUCTURES NANOSYS INC (US) 2008-03-05 EP disclosed
US-6949206-B2 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2005-09-27 US disclosed
US-20050205850-A1 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2005-09-22 US disclosed
US-20050205849-A1 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2005-09-22 US disclosed
EP-1537187-A2 ORGANIC SPECIES THAT FACILITATE CHARGE TRANSFER TO OR FROM NANOSTRUCTURES Nanosys, Inc. (US) 2005-06-08 EP disclosed
US-20050109989-A1 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. 2005-05-26 US disclosed
US-20040178390-A1 Organic species that facilitate charge transfer to or from nanostructures NANOSYS, INC. (US) 2004-09-16 US disclosed
WO-2004022714-A2 ORGANIC SPECIES THAT FACILITATE CHARGE TRANSFER TO OR FROM NANOSTRUCTURES NANOSYS, INC. (US) 2004-03-18 WO disclosed