SCHEMBL13820156

SCHEMBL13820156

Cc1nc2c(C)sc(C)c2nc1C

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.39
NQO2 P16083 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL9976517 0.75 NOS1 (0.31) NOS1
SCHEMBL3874742 0.73 MAPT (0.38) NQO2MAPT
SCHEMBL16284931 0.73 CDC7 (0.36) NOS1
SCHEMBL14729531 0.71
SCHEMBL12587616 0.69 ADORA2A (0.32)
SCHEMBL19781832 0.69 NOS1 (0.42) NOS1MAPT
SCHEMBL16284927 0.68 NOS1 (0.31) NOS1
SCHEMBL17225429 0.65 KMT2A (0.45)
SCHEMBL18748373 0.65
SCHEMBL18950072 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180009989-A1 BLUE-EXCITABLE WATER-SOLVATED POLYMERIC DYES BECTON, DICKINSON AND COMPANY 2018-01-11 US disclosed
US-9680103-B2 Organic photoelectric conversion element composition, thin film and photovoltaic cell each containing the same, organic semiconductor polymer and compound each for use in these, and method of producing the polymer FUJIFILM CORPORATION (JP) 2017-06-13 US disclosed
US-20150340633-A1 ORGANIC SOLAR CELL OF THE BULK HETEROJUNCTION TYPE COMPRISING AN IMIDE BASED CONJUGATED BACKBONE COMPOUND AS PHOTOACTIVE MATERIAL TATA STEEL NEDERLAND TECHNOLOGY B.V. (NL) 2015-11-26 US disclosed
US-20140360585-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT COMPOSITION, THIN FILM AND PHOTOVOLTAIC CELL EACH CONTAINING THE SAME, ORGANIC SEMICONDUCTOR POLYMER AND COMPOUND EACH FOR USE IN THESE, AND METHOD OF PRODUCING THE POLYMER FUJIFILM CORPORATION (JP) 2014-12-11 US disclosed
US-20140360585-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT COMPOSITION, THIN FILM AND PHOTOVOLTAIC CELL EACH CONTAINING THE SAME, ORGANIC SEMICONDUCTOR POLYMER AND COMPOUND EACH FOR USE IN THESE, AND METHOD OF PRODUCING THE POLYMER FUJIFILM CORPORATION (JP) 2014-12-11 US disclosed
US-20130306917-A1 QUINONE COMPOUNDS FOR USE IN PHOTOVOLTAIC APPLICATION RHODIA OPERATIONS (FR) 2013-11-21 US disclosed
US-8389670-B2 Dithienobenzo-thieno[3,2-B]thiophene-copolymer and its use as high performance solution processable semiconducting polymer BASF SE (DE) 2013-03-05 US disclosed
US-20120289672-A1 DITHIENOBENZO-THIENO[3,2-B]THIOPHENE-COPOLYMER AND ITS USE AS HIGH PERFORMANCE SOLUTION PROCESSABLE SEMICONDUCTING POLYMER MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2012-11-15 US disclosed