SCHEMBL6645804

SCHEMBL6645804

C=C(C)c1ccc(N(C(=O)O)C2CCNC2=O)c(F)c1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ APOL1 O14791 1/20 0.35
▸ DDB1 Q16531 1/20 0.33
▸ CRBN Q96SW2 1/20 0.33
▸ RAB9A P51151 2/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ 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 2/20 0.31
▸ 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
SCHEMBL6618582 0.91 ALDH1A1 (0.36) APOL1DDB1CRBNRAB9ANPC1
SCHEMBL6618579 0.91 ALDH1A1 (0.36) APOL1DDB1CRBNRAB9ANPC1
SCHEMBL6613347 0.81 APOL1 (0.37) APOL1DDB1CRBNPSEN1PSEN2
SCHEMBL6613354 0.81 APOL1 (0.37) APOL1DDB1CRBNPSEN1PSEN2
SCHEMBL6613398 0.81 CRBN (0.37) APOL1DDB1CRBNPSEN1PSEN2
SCHEMBL6613404 0.81 CRBN (0.37) APOL1DDB1CRBNPSEN1PSEN2
SCHEMBL6645767 0.79 FPR2 (0.36) APOL1DDB1CRBNPSEN1PSEN2
SCHEMBL6645760 0.79 FPR2 (0.36) APOL1DDB1CRBNPSEN1PSEN2
SCHEMBL6650942 0.79 APOL1 (0.36) APOL1DDB1CRBN
SCHEMBL6672074 0.76 KDM4E (0.41) RAB9ANPC1ALDH1A1

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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