SCHEMBL17372152

SCHEMBL17372152

CC1(C)CC(=O)c2c([nH]c(-c3ccnc(NC(=O)C4CC4)c3)c2Nc2ccccc2)C1.O=C1CC2(CC2)Cc2[nH]c(-c3ccncc3)c(Nc3ccccc3)c21

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 20/20 0.85

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
SCHEMBL17372071 0.93 BUB1 (0.82) BUB1
SCHEMBL17371952 0.92 BUB1 (1.00) BUB1
SCHEMBL17379650 0.85 BUB1 (0.85) BUB1
SCHEMBL17371959 0.85 BUB1 (1.00) BUB1
SCHEMBL17372047 0.84 BUB1 (1.00) BUB1
SCHEMBL17372040 0.84 BUB1 (1.00) BUB1
SCHEMBL17372550 0.84 BUB1 (1.00) BUB1
SCHEMBL17372542 0.84 BUB1 (1.00) BUB1
SCHEMBL17371831 0.84 BUB1 (1.00) BUB1
SCHEMBL17372545 0.84 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 4 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 claimed
WO-2015193339-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-12-23 — — WO claimed
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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