SCHEMBL20175445

SCHEMBL20175445

Cc1ncc(-c2ccc(-c3cnc(C)s3)s2)s1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.40
AOC3 Q16853 2/20 0.36
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
ADORA2A P29274 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
SLC6A3 Q01959 1/20 0.35
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
GLA P06280 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
PIK3CG P48736 1/20 0.34
PIK3C3 Q8NEB9 1/20 0.34
LRRK2 Q5S007 1/20 0.33
PTGS2 P35354 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
SCHEMBL10442133 0.91 NPC1 (0.39) HCAR2AOC3NOS3NOS2ADORA2A
SCHEMBL10442596 0.89 HCAR2 (0.46) HCAR2AOC3NOS3NOS2ADORA2A
SCHEMBL20288048 0.88 HCAR2 (0.33) HCAR2AOC3ADORA2ANPSR1CYP11B1
SCHEMBL16522148 0.79 NPC1 (0.35) HCAR2AOC3ADORA2ANPSR1CYP11B1
SCHEMBL3453513 0.78 CA1 (0.40) HCAR2AOC3KDM4EMAPTPIK3CD
SCHEMBL18885937 0.76 SLC6A3 (0.33) AOC3SLC6A3
SCHEMBL20040131 0.76 NOS1 (0.54) HCAR2AOC3ADORA2ANPSR1KDM4E
SCHEMBL19685720 0.76 HCAR2 (0.38) HCAR2AOC3ADORA2ANPSR1CYP11B1
SCHEMBL12537255 0.75 NPC1 (0.38) NOS3NOS2NPSR1KDM4ENPC1
SCHEMBL146522 0.75 KDR (0.52) AOC3SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10636975-B2 Organic semiconductor element, compound, organic semiconductor composition, and method of manufacturing organic semiconductor film FUJIFILM CORPORATION (JP) 2020-04-28 US disclosed
US-10312447-B2 Organic semiconductor element, manufacturing method thereof, compound, organic semiconductor composition, organic semiconductor film, and manufacturing method thereof FUJIFILM CORPORATION (JP) 2019-06-04 US disclosed
US-20190036029-A1 ORGANIC THIN FILM TRANSISTOR ELEMENT, ORGANIC SEMICONDUCTOR FILM-FORMING COMPOSITION, METHOD OF FORMING ORGANIC SEMICONDUCTOR FILM, AND ORGANIC SEMICONDUCTOR FILM FUJIFILM CORPORATION (JP) 2019-01-31 US disclosed
US-20180175300-A1 ORGANIC THIN FILM TRANSISTOR, METHOD OF MANUFACTURING ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, AND METHOD OF MANUFACTURING ORGANIC SEMICONDUCTOR FILM FUJIFILM CORPORATION (JP) 2018-06-21 US disclosed
US-20180145259-A1 ORGANIC SEMICONDUCTOR ELEMENT, COMPOUND, ORGANIC SEMICONDUCTOR COMPOSITION, AND METHOD OF MANUFACTURING ORGANIC SEMICONDUCTOR FILM FUJIFILM CORPORATION (JP) 2018-05-24 US disclosed
US-20180145258-A1 ORGANIC SEMICONDUCTOR ELEMENT, COMPOUND, ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, AND MANUFACTURING METHOD THEREOF FUJIFILM CORPORATION (JP) 2018-05-24 US disclosed