SCHEMBL28958167

SCHEMBL28958167

Cc1ccc(C2=CC=CC(F)(C=O)C2)cc1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 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
SCHEMBL30706497 0.65
SCHEMBL28658397 0.63 HDAC1 (0.33)
SCHEMBL2836934 0.63 ACHE (0.38)
SCHEMBL28513177 0.62 NPC1 (0.32)
SCHEMBL30163529 0.62 NPC1 (0.32)
SCHEMBL28540735 0.62 NPC1 (0.32)
SCHEMBL1116107 0.61 ACHE (0.36)
SCHEMBL22098144 0.60 NISCH (0.40)
SCHEMBL29407620 0.60 ACHE (0.35)
SCHEMBL20783684 0.60 ACHE (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114615969-A Novel process 帝斯曼知识产权资产管理有限公司 2022-06-10 CN claimed