SCHEMBL18434665

SCHEMBL18434665

COc1ccnc2c3c(ccc12)-c1ccccc1[S+]([O-])N3

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 11/20 0.55
▸ MAPK14 Q16539 2/20 0.35
▸ FYN P06241 2/20 0.34
▸ SCN9A Q15858 3/20 0.34

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
SCHEMBL18434842 0.81 SLC40A1 (0.52) SLC40A1
SCHEMBL18434791 0.81 SLC40A1 (0.52) SLC40A1MAPK14
SCHEMBL11995745 0.81 SLC40A1 (0.60) SLC40A1
SCHEMBL18434650 0.81 SLC40A1 (0.55) SLC40A1
SCHEMBL18434816 0.78 SLC40A1 (0.55) SLC40A1
SCHEMBL18434399 0.78 SLC40A1 (0.57) SLC40A1
SCHEMBL18434713 0.76 SLC40A1 (0.60) SLC40A1
SCHEMBL11995746 0.76 SLC40A1 (0.60) SLC40A1
SCHEMBL18434662 0.73 SLC40A1 (0.58) SLC40A1MAPK14
SCHEMBL11973651 0.71 SLC40A1 (1.00) 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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