SCHEMBL8143742

SCHEMBL8143742

CC(=O)N[C@@H](Cc1ccc(OP(=O)(O)O)c2c1CCCN2)C(=O)N[C@H]1CSc2ccccc2N(CCCC2CCCCC2)C1=O

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 18/20 0.61
▸ MME P08473 1/20 0.37
▸ ACE P12821 1/20 0.37
▸ LCK P06239 1/20 0.37

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
SCHEMBL8141790 0.86 SRC (0.61) SRCMMEACE
SCHEMBL8141810 0.86 SRC (0.61) SRCMMEACE
SCHEMBL8143753 0.81 SRC (0.44) SRC
SCHEMBL8150420 0.73 SRC (0.68) SRCMMEACE
SCHEMBL8150425 0.73 SRC (0.68) SRCMMEACE
SCHEMBL8136435 0.72 SRC (0.55) SRCMMEACE
SCHEMBL8136430 0.72 SRC (0.55) SRCMMEACE
SCHEMBL8142140 0.69 SRC (0.55) SRCMMEACE
SCHEMBL8142135 0.69 SRC (0.55) SRCMMEACE
SCHEMBL8141802 0.67 SRC (0.44) SRC

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
WO-2000005246-A1 THIOAZEPINONE DERIVATIVES, PREPARATION METHOD AND INTERMEDIATES THEREFOR, USE AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME HOECHST MARION ROUSSEL (FR) 2000-02-03 — — WO claimed
Send feedback