SCHEMBL29558223

SCHEMBL29558223

Cc1ccccc1P(c1ccccc1C)c1ccccc1C.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.37
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.32
KDM4C Q9H3R0 1/20 0.32

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
SCHEMBL29558334 0.85 TRPA1 (0.32) ACHETSHR
O-Xylene SCHEMBL30509215 0.81 TSHR (0.48) ACHETSHRHTTKDM4C
O-Xylene SCHEMBL30386408 0.81 TSHR (0.48) ACHETSHRHTTKDM4C
SCHEMBL30367230 0.81 TSHR (0.50) ACHETSHRHTT
SCHEMBL4015451 0.81 TSHR (0.50) ACHETSHRHTT
SCHEMBL29160259 0.79 ACHE (0.46) ACHETSHRHTT
Hydrochloric Acid SCHEMBL30217238 0.79 TSHR (0.47) ACHETSHRHTT
Hydrochloric Acid SCHEMBL105623 0.79 TSHR (0.47) ACHETSHRHTT
Hydrochloric Acid SCHEMBL5908722 0.79 TSHR (0.47) ACHETSHRHTT
SCHEMBL4480 0.78 TSHR (0.53) ACHETSHRHTT

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-118475588-A Transition metal compound, catalyst composition comprising the same, and method for preparing olefin polymer using the same 沙特基础工业爱思开NEXLENE私人有限公司 2024-08-09 CN disclosed
CN-111989336-B Metal complexes comprising amidine and indole fused cyclopentadienyl ligands 阿朗新科荷兰有限公司 2023-07-07 CN disclosed
CN-109641977-B Method for inhibiting reactor fouling and olefin oligomerization using same SK新技术株式会社 2022-04-12 CN disclosed