SCHEMBL18481373

SCHEMBL18481373

O=C1CC(C(O)O)Cc2[nH]c(-c3ccncc3)c(Nc3ccccc3)c21

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
SCHEMBL17371883 0.89 BUB1 (1.00) BUB1
SCHEMBL18695333 0.89 BUB1 (1.00) BUB1
SCHEMBL17372405 0.89 BUB1 (1.00) BUB1
SCHEMBL18329960 0.87 BUB1 (0.71) BUB1
SCHEMBL18320167 0.86 BUB1 (1.00) BUB1
SCHEMBL17372037 0.84 BUB1 (1.00) BUB1
SCHEMBL20470448 0.84 BUB1 (0.81) BUB1
SCHEMBL18320098 0.84 BUB1 (1.00) BUB1
SCHEMBL18320078 0.84 BUB1 (1.00) BUB1
SCHEMBL18320364 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3331611-B1 1H-PYRROL-3-AMINES Bayer Pharma AG (DE) 2021-06-02 — — EP disclosed
WO-2017021348-A1 1H-PYRROL-3-AMINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-02-09 — — WO disclosed
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