SCHEMBL8000219

SCHEMBL8000219

CN(c1ccc(CO[Si](C)(C)C(C)(C)C)cc1)S(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 3/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
GALR3 O60755 1/20 0.36
TSHR P16473 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP19A1 P11511 4/20 0.34
TP53 P04637 1/20 0.34
PKM P14618 1/20 0.34
GAA P10253 1/20 0.34
RECQL P46063 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
IKBKB O14920 1/20 0.33

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
SCHEMBL13412262 0.81 RAB9A (0.33) SMN1; SMN2LMNAL3MBTL1NPC1RAB9A
SCHEMBL26398329 0.78 PTGS2 (0.43)
SCHEMBL2882144 0.78 CA2 (0.40) KMT2A
SCHEMBL835705 0.77 CA2 (0.39) KMT2A
SCHEMBL13412263 0.75 BACE1 (0.32) SMN1; SMN2NPC1RAB9ATP53PTGDR2
SCHEMBL16369618 0.74 CA2 (0.59) SMN1; SMN2
SCHEMBL3586423 0.74 CA2 (0.43) LMNAKMT2A
SCHEMBL31138173 0.73 CA2 (0.33)
SCHEMBL12621548 0.73 CA12 (0.31)
Bromide SCHEMBL21962535 0.73 BACE1 (0.34)

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-6294573-B1 FOR THERAPY RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, OSTEOPENIAS SUCH AS OSTEOPOROSIS, PERIODONTITIS, GINGIVITIS, CORNEAL, EPIDERMAL OR GASTRIC ULCERATION, AND TUMOR GROWTH AND METASTASIS OR INVASION ABBOTT LABORATORIES 2001-09-25 US disclosed