SCHEMBL28763518

SCHEMBL28763518

BrCCCCCCSCCCCCCBr

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL7128319 0.86 CES2 (0.46) TSHR
SCHEMBL9862658 0.86 CES2 (0.46) TSHR
SCHEMBL14306294 0.86 CES2 (0.41) TSHR
SCHEMBL7132002 0.86 CES2 (0.37)
SCHEMBL9351573 0.85
SCHEMBL10447882 0.82
SCHEMBL19899968 0.82 TSHR (0.41) TSHR
SCHEMBL18636776 0.80
SCHEMBL20244290 0.80
SCHEMBL4235086 0.80

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114634432-B High-efficiency synthesis method of alkyl aryl thioether compound 润药仁智(北京)科技有限公司 2023-03-14 CN disclosed
CN-114634432-A High-efficiency synthesis method of alkyl aryl thioether compound 北京大学 2022-06-17 CN disclosed