SCHEMBL17371996

SCHEMBL17371996

CC(C)CC1CC(=O)c2c([nH]c(-c3ccncc3)c2Nc2ccccc2)C1.CCC1CC(=O)c2c([nH]c(-c3ccncc3)c2Nc2ccccc2)C1

nearest known ligand 0.93

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 20/20 0.93

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
SCHEMBL17372223 0.96 BUB1 (1.00) BUB1
SCHEMBL17371927 0.93 BUB1 (1.00) BUB1
SCHEMBL18320318 0.87 BUB1 (1.00) BUB1
SCHEMBL20212635 0.87 BUB1 (1.00) BUB1
SCHEMBL18320806 0.84 BUB1 (1.00) BUB1
SCHEMBL17372256 0.83 BUB1 (1.00) BUB1
SCHEMBL17371814 0.83 BUB1 (1.00) BUB1
SCHEMBL17372247 0.83 BUB1 (1.00) BUB1
SCHEMBL18319982 0.83 BUB1 (1.00) BUB1
SCHEMBL20212663 0.83 BUB1 (1.00) BUB1

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
EP-3157914-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES Bayer Pharma Aktiengesellschaft (DE) 2017-04-26 — — EP disclosed
WO-2015193339-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-12-23 — — WO disclosed
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