SCHEMBL18320108

SCHEMBL18320108

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

nearest known ligand 0.75

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 20/20 0.75

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
SCHEMBL20233905 0.89 BUB1 (0.87) BUB1
SCHEMBL18320187 0.86 BUB1 (0.75) BUB1
SCHEMBL18319918 0.85 BUB1 (1.00) BUB1
SCHEMBL17372187 0.85 BUB1 (1.00) BUB1
SCHEMBL18321144 0.85 BUB1 (0.78) BUB1
SCHEMBL23431185 0.84 BUB1 (1.00) BUB1
SCHEMBL18481392 0.84 BUB1 (1.00) BUB1
SCHEMBL20233967 0.83 BUB1 (0.77) BUB1
SCHEMBL18321133 0.83 BUB1 (0.81) BUB1
SCHEMBL18986493 0.82 BUB1 (0.74) 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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