SCHEMBL28057567

SCHEMBL28057567

CC(C)c1c(N)ccc(-c2ccc(N)cc2)c1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
CYP3A4 P08684 4/20 0.39
TDP1 Q9NUW8 4/20 0.39
TP53 P04637 3/20 0.39
USP7 Q93009 1/20 0.36
HSD17B10 Q99714 3/20 0.33
RPS6KA3 P51812 2/20 0.33
TAAR1 Q96RJ0 1/20 0.33
KDM5B Q9UGL1 1/20 0.33
GRIA4 P48058 1/20 0.33
MEN1 O00255 4/20 0.32
KMT2A Q03164 4/20 0.32
MAPT P10636 3/20 0.32
KDM4E B2RXH2 3/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
APP P05067 1/20 0.31
TSHR P16473 1/20 0.31
CHEK1 O14757 1/20 0.31
DAPK3 O43293 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
Methane SCHEMBL28536983 0.98 CYP3A4 (0.37) ALDH1A1CYP3A4TDP1TP53USP7
SCHEMBL7006145 0.85 DHFR (0.39) ALDH1A1CYP3A4TDP1TP53USP7
SCHEMBL5382005 0.80 ALDH1A1 (0.32) ALDH1A1CYP3A4TDP1TP53USP7
SCHEMBL8637586 0.79 CYP3A4 (0.42) ALDH1A1CYP3A4TDP1TP53USP7
SCHEMBL8629720 0.78 GRIA4 (0.36) ALDH1A1CYP3A4TDP1TP53HSD17B10
SCHEMBL924270 0.78 ALDH1A1 (0.37) ALDH1A1CYP3A4TDP1TP53USP7
Methane SCHEMBL28126707 0.77 GRIA4 (0.35) ALDH1A1CYP3A4TDP1TP53HSD17B10
SCHEMBL1876622 0.76 USP7 (0.43) ALDH1A1CYP3A4TDP1TP53USP7
SCHEMBL7671735 0.73 CA1 (0.44) ALDH1A1CYP3A4TDP1TP53USP7
SCHEMBL10555315 0.72 USP7 (0.40) ALDH1A1CYP3A4TDP1TP53USP7

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
CN-109679094-A Polyimide precursor and polyimides, laminated body, flexible device 日铁化学材料株式会社 2019-04-26 CN disclosed
CN-106083927-B Phosphino- amidine compound, metal complex, antigravity system and their oligomeric or olefin polymerization purposes 切弗朗菲利浦化学公司 2018-10-26 CN disclosed
CN-106083927-A Phosphinyl amidine compound, metal complex, antigravity system and their oligomeric or purposes of olefin polymerization 切弗朗菲利浦化学公司 2016-11-09 CN disclosed
CN-106028633-A COPPER-CLAD LAMINATE AND PRINTED WIRING BOARD 新日铁住金化学株式会社 2016-10-12 CN disclosed
CN-102781949-B Phosphinyl amidine compounds, metal complexes, catalyst systems, and their use for oligomerizing or polymerizing olefins 切弗朗菲利浦化学公司 2016-07-06 CN disclosed
CN-105339416-A Polyimide, resin film, and metal-clad laminate NIPPON STEEL & SUMIKIN CHEM CO 2016-02-17 CN disclosed