SCHEMBL18434713

SCHEMBL18434713

CNC(=O)c1ccnc2c3c(ccc12)-c1ccccc1[S+]([O-])N3

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 15/20 0.60
▸ SYK P43405 1/20 0.35
▸ ALOX5AP P20292 1/20 0.34
▸ FEN1 P39748 1/20 0.34
▸ PLK1 P53350 1/20 0.34
▸ AR P10275 1/20 0.33
▸ PSMD14 O00487 1/20 0.32

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
SCHEMBL11995745 0.87 SLC40A1 (0.60) SLC40A1PSMD14
SCHEMBL11995746 0.85 SLC40A1 (0.60) SLC40A1
SCHEMBL18434791 0.77 SLC40A1 (0.52) SLC40A1
SCHEMBL18434842 0.77 SLC40A1 (0.52) SLC40A1
SCHEMBL11973273 0.76 SLC40A1 (0.63) SLC40A1SYKALOX5APFEN1PLK1
SCHEMBL18434650 0.76 SLC40A1 (0.55) SLC40A1
SCHEMBL18434665 0.76 SLC40A1 (0.55) SLC40A1
SCHEMBL11995696 0.75 SLC40A1 (1.00) SLC40A1
SCHEMBL18434816 0.74 SLC40A1 (0.55) SLC40A1AR
SCHEMBL18434399 0.73 SLC40A1 (0.57) SLC40A1

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-2675526-B1 NOVEL SULFONAMINOQUINOLINE HEPCIDIN ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2017-02-01 — — EP disclosed
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