SCHEMBL29697793

SCHEMBL29697793

C[SH]1(=O)Nc2cc(F)c(F)cc2-c2ccccc21

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GPR3 P46089 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
SCHEMBL15220201 0.64 CDC25B (0.36) GPR3
SCHEMBL10607728 0.58 MEN1 (0.63) —
SCHEMBL25406079 0.55 — —
SCHEMBL30886640 0.55 PTPRC (0.62) —
SCHEMBL24673413 0.55 MEN1 (0.38) —
SCHEMBL18900025 0.54 MAOA (0.34) —
SCHEMBL5384811 0.52 BACE1 (0.50) GPR3
SCHEMBL6189481 0.52 ACMSD (0.42) —
SCHEMBL9240891 0.51 MEN1 (0.43) GPR3
SCHEMBL197834 0.50 ACHE (0.47) —

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-110698431-B Synthetic method of 1, 2-benzothiazine compound 陕西师范大学 2022-07-01 — — CN disclosed
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