SCHEMBL6613404

SCHEMBL6613404

Nc1ccc(N(C(=O)O)C2CCNC2=O)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 3/20 0.37
▸ APOL1 O14791 1/20 0.35
▸ DDB1 Q16531 1/20 0.33
▸ PSEN1 P49768 1/20 0.31
▸ PSEN2 P49810 1/20 0.31
▸ APH1B Q8WW43 1/20 0.31
▸ NCSTN Q92542 1/20 0.31
▸ APH1A Q96BI3 1/20 0.31
▸ PSENEN Q9NZ42 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL6613398 1.00 CRBN (0.37) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6613354 0.85 APOL1 (0.37) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6613347 0.85 APOL1 (0.37) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6618582 0.83 ALDH1A1 (0.36) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6618579 0.83 ALDH1A1 (0.36) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6645767 0.83 FPR2 (0.36) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6645760 0.83 FPR2 (0.36) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6645804 0.81 APOL1 (0.35) CRBNAPOL1DDB1PSEN1PSEN2
SCHEMBL6650942 0.80 APOL1 (0.36) CRBNAPOL1DDB1
SCHEMBL6672070 0.78 KDM4E (0.41) ALDH1A1

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-1456172-A1 PYRROLIDINE-2-ONES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2004-09-15 — — EP disclosed
WO-2003053925-A1 PYRROLIDINE-2-ONES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2003-07-03 — — WO disclosed
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