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SCHEMBL8359281

SCHEMBL8359281

C[C@H](CC=C(Br)Br)[C@H]1CCC[C@H]2[C@@H](O[Si](C)(C)C(C)(C)C)CCC[C@]12C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CDC25A P30304 2/20 0.38
▸ CDC25B P30305 2/20 0.38
▸ PPM1D O15297 2/20 0.36
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ TYK2 P29597 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ GPBAR1 Q8TDU6 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
SCHEMBL8359286 1.00 CDC25A (0.38) CDC25ACDC25BPPM1DJAK2JAK1
SCHEMBL8359283 1.00 CDC25A (0.38) CDC25ACDC25BPPM1DJAK2JAK1
SCHEMBL7145028 0.86 CDC25A (0.40) CDC25ACDC25BPPM1DGPBAR1
SCHEMBL7145023 0.86 CDC25A (0.40) CDC25ACDC25BPPM1DGPBAR1
SCHEMBL7145089 0.85 CDC25A (0.42) CDC25ACDC25BPPM1DGPBAR1
SCHEMBL8201371 0.85 CDC25A (0.42) CDC25ACDC25BPPM1DGPBAR1
SCHEMBL7145024 0.85 CDC25A (0.42) CDC25ACDC25BPPM1DGPBAR1
SCHEMBL8207424 0.84 PPM1D (0.34) CDC25ACDC25BPPM1D
SCHEMBL8207420 0.84 PPM1D (0.34) CDC25ACDC25BPPM1D
SCHEMBL8098457 0.82 CDC25A (0.39) CDC25ACDC25BPPM1D

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
US-5919986-A SKIN DISORDERS; OSTEOPOROSIS; KIDNEY DISORDERS; MULTIPLE SCLEROSIS HOFFMANN-LA ROCHE INC. (US) 1999-07-06 — — US disclosed