SCHEMBL10596819

SCHEMBL10596819

CCN1CCN(C(=O)NC(C([NH])=O)c2cc(OC(C)=O)c(OC(C)=O)cc2Br)C(=O)C1=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ POLB P06746 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
SCHEMBL10595798 0.91 MEN1 (0.33) SMN1; SMN2MEN1KMT2APOLB
SCHEMBL10802418 0.90 SMN1; SMN2 (0.33) SMN1; SMN2MEN1KMT2APOLB
SCHEMBL9770397 0.83 SMN1; SMN2 (0.35) SMN1; SMN2POLB
SCHEMBL10594005 0.79 POLB (0.37) SMN1; SMN2POLB
SCHEMBL10594166 0.79 GAA (0.32) SMN1; SMN2POLB
SCHEMBL10597320 0.79 POLB (0.37) SMN1; SMN2POLB
SCHEMBL10401792 0.79 POLB (0.37) SMN1; SMN2POLB
SCHEMBL10596773 0.78 SMN1; SMN2 (0.33) SMN1; SMN2POLB
SCHEMBL10401867 0.76 TSHR (0.34) SMN1; SMN2POLB
SCHEMBL9770262 0.75 POLB (0.35) SMN1; SMN2POLB

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-0131174-B1 SUBSTITUTED PHENYLGLYCINE DERIVATIVES OF BETA-LACTAM ANTIBIOTICS BEECHAM GROUP PLC (GB) 1989-09-13 — — EP disclosed
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