Sugi Predict

Sugi Predict / Compounds / SCHEMBL7305229

SCHEMBL7305229

SCHEMBL7305229

N=C(N)c1ccc(CNC(=O)[C@]23C[C@H]2CCN3C(=O)[C@H](NCC(=O)O)C(C2CCCCC2)C2CCCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PROC P04070 13/20 0.51
▸ F2 P00734 12/20 0.51
▸ F10 P00742 1/20 0.51
▸ F7 P08709 1/20 0.51

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
Hydrochloric Acid SCHEMBL7958342 0.99 F2 (0.50) PROCF2F10F7
SCHEMBL7400135 0.87 F2 (0.61) PROCF2F10F7
SCHEMBL7314375 0.86 F2 (0.49) PROCF2F10F7
Hydrochloric Acid SCHEMBL7958396 0.86 F2 (0.60) PROCF2F10F7
Hydrochloric Acid SCHEMBL7951514 0.85 F2 (0.51) PROCF2F10F7
SCHEMBL7306531 0.82 PROC (0.55) PROCF2F10F7
SCHEMBL7393489 0.82 PROC (0.57) PROCF2F10F7
SCHEMBL7304476 0.81 F2 (0.47) PROCF2
SCHEMBL7310191 0.81 F2 (0.47) PROCF2F10F7
Hydrochloric Acid SCHEMBL7951566 0.81 PROC (0.55) PROCF2F10F7

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-1050534-B1 2,3-methano-amino acid derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2001-12-05 — — EP disclosed
EP-1050534-A1 2,3-methano-amino acid derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 2000-11-08 — — EP disclosed
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