SCHEMBL8896746

SCHEMBL8896746

CCCN(CCC)c1ccc(N=Nc2c(C#N)cc(C)cc2C#N)c(NS(C)(=O)=O)c1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 4/20 0.37
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
GFER P55789 1/20 0.31
TRPV1 Q8NER1 1/20 0.30

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
SCHEMBL8896740 1.00 NR3C1 (0.37) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL29459612 0.96 GFER (0.35) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL17342985 0.94 NR3C1 (0.36) NR3C1
SCHEMBL31173922 0.92 MAPT (0.38) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL8898950 0.92 MAPT (0.38) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL8898945 0.92 MAPT (0.38) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL17342988 0.89 TRPV1 (0.32) NR3C1TRPV1
SCHEMBL9588417 0.88 CYP19A1 (0.37) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL9588413 0.88 CYP19A1 (0.37) NR3C1KDM4EMEN1MAPTKMT2A
SCHEMBL21310400 0.86 KCNH2 (0.37) NR3C1MEN1MAPTKMT2AGFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5698018-A Heat transferring inkjet ink images EASTMAN KODAK COMPANY (US) 1997-12-16 US claimed
CN-119060560-A Red disperse dye composition with low metamerism index and preparation method and application thereof 绍兴文理学院 2024-12-03 CN disclosed
US-5698018-A Heat transferring inkjet ink images EASTMAN KODAK COMPANY (US) 1997-12-16 US disclosed
US-5698018-A Heat transferring inkjet ink images EASTMAN KODAK COMPANY (US) 1997-12-16 US disclosed