SCHEMBL6650942

SCHEMBL6650942

O=C1NCCC1N(C(=O)O)c1ccc(-c2ncccn2)cc1F

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ APOL1 O14791 1/20 0.36
▸ VCP P55072 1/20 0.34
▸ KAT6A Q92794 2/20 0.34
▸ LIPG Q9Y5X9 3/20 0.33
▸ ALOX5AP P20292 3/20 0.32
▸ FEN1 P39748 3/20 0.32
▸ FFAR4 Q5NUL3 4/20 0.32
▸ TNK2 Q07912 1/20 0.31
▸ ACACB O00763 1/20 0.31
▸ FPR2 P25090 1/20 0.31
▸ SCN9A Q15858 1/20 0.31
▸ DDB1 Q16531 1/20 0.31
▸ CRBN Q96SW2 1/20 0.31
▸ KCNH2 Q12809 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
SCHEMBL6614630 0.84 CCNC (0.35) APOL1LIPG
SCHEMBL6614624 0.84 CCNC (0.35) APOL1LIPG
SCHEMBL6613404 0.80 CRBN (0.37) APOL1DDB1CRBN
SCHEMBL6613347 0.80 APOL1 (0.37) APOL1DDB1CRBN
SCHEMBL6613354 0.80 APOL1 (0.37) APOL1DDB1CRBN
SCHEMBL6613398 0.80 CRBN (0.37) APOL1DDB1CRBN
SCHEMBL6645760 0.78 FPR2 (0.36) APOL1FPR2DDB1CRBN
SCHEMBL6645767 0.78 FPR2 (0.36) APOL1FPR2DDB1CRBN
SCHEMBL6672074 0.73 KDM4E (0.41) —
SCHEMBL6672070 0.73 KDM4E (0.41) —

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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