SCHEMBL18321133

SCHEMBL18321133

[CH2]C1CC(=O)c2c([nH]c(-c3ccnc(NC(C)=O)c3)c2Nc2ccccc2)C1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 20/20 0.81

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
SCHEMBL20233877 0.91 BUB1 (0.88) BUB1
SCHEMBL18319985 0.89 BUB1 (1.00) BUB1
SCHEMBL17371892 0.88 BUB1 (1.00) BUB1
SCHEMBL17372058 0.88 BUB1 (1.00) BUB1
SCHEMBL18481892 0.88 BUB1 (1.00) BUB1
SCHEMBL18320106 0.88 BUB1 (0.78) BUB1
SCHEMBL20233978 0.87 BUB1 (1.00) BUB1
SCHEMBL18320123 0.87 BUB1 (1.00) BUB1
SCHEMBL20226422 0.87 BUB1 (1.00) BUB1
SCHEMBL17372130 0.87 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-3310775-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-04-25 — — EP disclosed
WO-2016202755-A1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-12-22 — — WO disclosed
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