SCHEMBL28216141

SCHEMBL28216141

Cc1cccc(C)c1C1=CC=C[CH]1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.36
CYP1A2 P05177 1/20 0.36
CD44 P16070 1/20 0.36
TSHR P16473 1/20 0.35
ACHE P22303 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 2/20 0.35
CA9 Q16790 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MYC P01106 1/20 0.31
TRPA1 O75762 2/20 0.31
ATM Q13315 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
SCHEMBL19469152 0.76 TRPA1 (0.37) CYP2A6CYP1A2TSHRACHECA1
SCHEMBL19469140 0.74 TSHR (0.39) TSHRACHECA1CA2CA7
SCHEMBL27988044 0.71 CA1 (0.42) TSHRCA1CA2CA7CA9
SCHEMBL4021982 0.69 ACHE (0.57) CYP2A6CYP1A2CD44TSHRACHE
SCHEMBL27987701 0.67 ACHE (0.44) TSHRACHEALDH1A1
SCHEMBL5082785 0.67 CYP2A6 (0.36) CYP2A6CYP1A2CD44TSHRACHE
SCHEMBL28185415 0.63 ACHE (0.40) CYP2A6ACHECA1CA2CA7
SCHEMBL4161420 0.62 CA1 (0.48) CYP2A6CYP1A2CD44TSHRACHE
SCHEMBL27745833 0.62 ALDH1A1 (0.42) CYP1A2ALDH1A1CYP3A4TDP1
SCHEMBL28899579 0.60 MYC (0.58) CYP2A6CYP1A2CD44TSHRACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107365397-B Multimodal polyolefin resin having high melt strength and shaped product made therefrom DL化学株式会社 2021-10-29 CN disclosed
CN-108350113-B Multimodal polyolefin resin and molded body produced therefrom 大林产业株式会社 2021-05-25 CN disclosed
CN-104203996-B Multimodal polyolefin resin and formed body prepared therefrom 大林产业株式会社 2018-04-20 CN disclosed