SCHEMBL21894301

SCHEMBL21894301

CNc1cc(-c2[nH]c3c(c2Nc2ccccc2)C(=O)CC(CSC(C)C)C3)ccn1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BUB1 O43683 20/20 0.80

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
SCHEMBL21894296 0.91 BUB1 (0.81) BUB1
SCHEMBL20212671 0.90 BUB1 (0.82) BUB1
SCHEMBL20233903 0.89 BUB1 (1.00) BUB1
SCHEMBL18320117 0.89 BUB1 (1.00) BUB1
SCHEMBL20234025 0.88 BUB1 (0.77) BUB1
SCHEMBL20212599 0.87 BUB1 (1.00) BUB1
SCHEMBL18320377 0.87 BUB1 (1.00) BUB1
SCHEMBL20234038 0.87 BUB1 (1.00) BUB1
SCHEMBL18320806 0.87 BUB1 (1.00) BUB1
SCHEMBL20212574 0.86 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3310775-B1 3-AMINO-1,5,6,7-TETRAHYDRO-4H-INDOL-4-ONES Bayer Pharma AG (DE) 2020-04-01 — — EP disclosed
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