SCHEMBL1897640

SCHEMBL1897640

CCCCCCCCC#Cc1cccs1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.50
ADORA3 P0DMS8 3/20 0.43
ADORA2A P29274 3/20 0.43
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.39
FFAR1 O14842 1/20 0.39
FFAR4 Q5NUL3 1/20 0.39
MMP2 P08253 1/20 0.38
MMP12 P39900 1/20 0.38
GRM5 P41594 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL7684841 1.00 KCNH2 (0.50) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL1898264 0.98 KCNH2 (0.49) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL7063023 0.98 KCNH2 (0.47) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL28663062 0.93 ADORA3 (0.45) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL7567357 0.85 GRM5 (0.42) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL23014790 0.85 ADORA3 (0.39) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL23014867 0.85 ADORA3 (0.39) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL5100660 0.85 KCNH2 (0.40) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL23015003 0.85 KCNH2 (0.37) KCNH2ADORA3ADORA2AADORA2BADORA1
SCHEMBL5100651 0.85 KCNH2 (0.40) KCNH2ADORA3ADORA2AADORA2BADORA1

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 33 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
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-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-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
CN-1688670-A Organic matter for promoting charge transfer to or from nano structure NANOSYS INC (US) 2005-10-26 CN 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