SCHEMBL20175446

SCHEMBL20175446

Cc1cnc(-c2ccc(-c3ncc(C)s3)s2)s1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.44
SRC P12931 1/20 0.38
CDK2 P24941 1/20 0.38
ZAP70 P43403 1/20 0.38
SYK P43405 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
KDR P35968 1/20 0.35
FDPS P14324 1/20 0.35
HDAC4 P56524 2/20 0.35
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
NPC1 O15118 6/20 0.33
RAB9A P51151 6/20 0.33
MAPT P10636 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
SMN1; SMN2 Q16637 3/20 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
SCHEMBL10141290 0.93 NOS1 (0.43) NOS1SRCCDK2ZAP70SYK
SCHEMBL20288050 0.88 NOS1 (0.36) NOS1SRCCDK2ZAP70SYK
SCHEMBL299972 0.86 MAPT (0.42) NOS1SRCCDK2ZAP70SYK
SCHEMBL12462949 0.86 NOS1 (0.38) NOS1SRCCDK2ZAP70SYK
SCHEMBL8270602 0.86 CYP2A6 (0.42) NOS1SRCCDK2ZAP70SYK
SCHEMBL289461 0.84 DPP4 (0.44) ADORA2AADORA1NPC1RAB9AMAPT
SCHEMBL10141023 0.82 NOS1 (0.35) NOS1SRCCDK2ZAP70SYK
SCHEMBL10002194 0.82 NOS1 (0.55) NOS1SRCCDK2ZAP70SYK
SCHEMBL25165413 0.80 SRC (0.37) NOS1SRCCDK2ZAP70SYK
SCHEMBL12537251 0.79 NPC1 (0.39) NOS1HDAC4NOS3NOS2NPC1

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-20180145258-A1 ORGANIC SEMICONDUCTOR ELEMENT, COMPOUND, ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC SEMICONDUCTOR FILM, AND MANUFACTURING METHOD THEREOF FUJIFILM CORPORATION (JP) 2018-05-24 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