SCHEMBL13372730

SCHEMBL13372730

COC1CN(C(=O)c2nc3c(s2)C(C)N(C)CC3)CC1NC(=O)Oc1ccc(Cl)s1

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 17/20 0.40
▸ F2 P00734 1/20 0.30

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
SCHEMBL13395104 0.89 F10 (0.50) F10F2
SCHEMBL3307545 0.89 F10 (0.50) F10F2
SCHEMBL13372815 0.85 F10 (0.55) F10F2
SCHEMBL13372905 0.83 F10 (0.33) F10
SCHEMBL13412964 0.81 F10 (0.33) F10
SCHEMBL4435127 0.75 F10 (0.32) F10
SCHEMBL13395100 0.74 F10 (0.61) F10
SCHEMBL13372898 0.74 F10 (0.33) F10F2
SCHEMBL4583647 0.74 F10 (0.38) F10
SCHEMBL3313491 0.74 F10 (0.70) F10

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-2132193-B1 SUBSTITUTED PYRROLIDINE AMIDES, THE PRODUCTION THEREOF, AND THE USE THEREOF AS MEDICATIONS BOEHRINGER INGELHEIM INT (DE) 2012-10-24 — — EP disclosed
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