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Sugi Predict / Compounds / SCHEMBL19966587

SCHEMBL19966587

SCHEMBL19966587

CSOCC12CCC(NC(=O)OC(C)(C)C)(CC1)C2

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ FOLH1 Q04609 1/20 0.33
▸ DPP8 Q6V1X1 2/20 0.32
▸ DPP9 Q86TI2 2/20 0.32
▸ CTSL P07711 1/20 0.31
▸ APLNR P35414 1/20 0.30

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
SCHEMBL14476349 0.81 MEN1 (0.37) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL19966403 0.81 MEN1 (0.33) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL19953322 0.80 MEN1 (0.33) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL29935596 0.78 TDP1 (0.37) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL29709304 0.78 MEN1 (0.37) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL19953443 0.76 FOLH1 (0.33) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL19966582 0.76 DPP8 (0.31) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL29419561 0.76 CTSL (0.39) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL16244106 0.76 MEN1 (0.34) MEN1MAPK1KMT2AFOLH1DPP8
SCHEMBL15979034 0.75 MEN1 (0.37) MEN1MAPK1KMT2AFOLH1DPP8

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
WO-2018047081-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF ENDOSOMAL TOLL-LIKE RECEPTORS NOVARTIS AG (CH) 2018-03-15 — — WO disclosed