SCHEMBL17802689

SCHEMBL17802689

NC(=O)Cc1cccc(-c2cc(COc3ccccc3CC(=O)O)cc(NC[C@@H]3CCCO3)c2)c1F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 12/20 0.57
▸ F11 P03951 8/20 0.42
▸ TPSB2 P20231 5/20 0.42
▸ KLKB1 P03952 4/20 0.42
▸ PLG P00747 2/20 0.42
▸ PLAU P00749 2/20 0.42
▸ F7 P08709 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ PTGER1 P34995 1/20 0.41
▸ PTGER4 P35408 1/20 0.41
▸ PTGER3 P43115 1/20 0.41
▸ PTGER2 P43116 1/20 0.41
▸ HPGD P15428 3/20 0.41
▸ CCR5 P51681 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL17802687 1.00 CFD (0.57) CFDF11TPSB2KLKB1PLG
SCHEMBL16396329 0.89 CFD (0.47) CFDF11TPSB2KLKB1PLG
SCHEMBL17764233 0.89 CFD (0.47) CFDF11TPSB2KLKB1PLG
SCHEMBL17764265 0.88 CFD (0.44) CFDF11TPSB2KLKB1PLG
SCHEMBL16396454 0.88 CFD (0.44) CFDF11TPSB2KLKB1PLG
SCHEMBL17802658 0.88 CFD (0.62) CFDF11TPSB2KLKB1PLG
SCHEMBL17802726 0.88 CFD (0.58) CFDF11TPSB2KLKB1PLG
SCHEMBL17802752 0.87 CFD (0.52) CFDF11TPSB2KLKB1PLG
SCHEMBL17802738 0.87 CFD (0.52) CFDF11TPSB2KLKB1PLG
SCHEMBL17764243 0.87 CFD (0.45) CFDF11TPSB2KLKB1PLG

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
WO-2016088082-A1 AMIDOMETHYL-BIARYL DERIVATIVES COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2016-06-09 — — WO claimed
WO-2016088082-A1 AMIDOMETHYL-BIARYL DERIVATIVES COMPLEMENT FACTOR D INHIBITORS AND USES THEREOF NOVARTIS AG (CH) 2016-06-09 — — WO disclosed
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