SCHEMBL30166047

SCHEMBL30166047

Cc1cc(C)c(F)cc1C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
ACHE P22303 1/20 0.38
GPR3 P46089 1/20 0.37
DAO P14920 1/20 0.34
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RAPGEF4 Q8WZA2 2/20 0.32
ALDH1A1 P00352 1/20 0.30
TUBB1 Q9H4B7 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
SCHEMBL18867947 1.00 CYP3A4 (0.40) CYP3A4TSHRMAPK1ACHEGPR3
SCHEMBL1057045 1.00 CYP3A4 (0.40) CYP3A4TSHRMAPK1ACHEGPR3
SCHEMBL261036 0.93 ACHE (0.42) CYP3A4TSHRMAPK1ACHEGPR3
SCHEMBL10147311 0.89 ACHE (0.40) CYP3A4TSHRMAPK1ACHEGPR3
SCHEMBL823783 0.86 ACHE (0.38) ACHEGPR3DAOHDAC1HDAC6
SCHEMBL5616902 0.85 ACHE (0.42) CYP3A4TSHRMAPK1ACHEHDAC1
SCHEMBL30867032 0.85 ACHE (0.42) CYP3A4TSHRMAPK1ACHEHDAC1
Hydrochloric Acid SCHEMBL29178225 0.83 ACHE (0.36) ACHEGPR3DAOHDAC1HDAC6
Bromide SCHEMBL28031443 0.83 ACHE (0.36) ACHEGPR3DAOHDAC1HDAC6
SCHEMBL24710388 0.80 GPR3 (0.43) ACHEGPR3DAOHDAC1HDAC6

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-120192204-A Preparation method of fluoro aromatic hydrocarbon compound 阜新孚隆宝医药科技有限公司 2025-06-24 CN claimed
CN-115490658-B Preparation method of 4,4' -oxydiphthalic anhydride 天津众泰材料科技有限公司 2023-11-14 CN claimed
CN-115490658-A Preparation method of 4,4' -oxydiphthalic anhydride 天津众泰材料科技有限公司 2022-12-20 CN claimed
CN-120192204-A Preparation method of fluoro aromatic hydrocarbon compound 阜新孚隆宝医药科技有限公司 2025-06-24 CN disclosed
CN-115490658-B Preparation method of 4,4' -oxydiphthalic anhydride 天津众泰材料科技有限公司 2023-11-14 CN disclosed
CN-115490658-A Preparation method of 4,4' -oxydiphthalic anhydride 天津众泰材料科技有限公司 2022-12-20 CN disclosed