SCHEMBL18434817

SCHEMBL18434817

CN1CCN(C(=O)c2ccc3c(c2)-c2cc(Cl)c4cccnc4c2N[S+]3[O-])CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 17/20 0.57
▸ RIPK1 Q13546 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ METAP2 P50579 1/20 0.40

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
SCHEMBL18434471 0.90 SLC40A1 (0.66) SLC40A1RIPK1KDM4EL3MBTL1METAP2
SCHEMBL18434695 0.82 SLC40A1 (0.63) SLC40A1KDM4EL3MBTL1
SCHEMBL11973270 0.81 SLC40A1 (0.83) SLC40A1
SCHEMBL18434773 0.80 SLC40A1 (0.59) SLC40A1RIPK1KDM4EL3MBTL1METAP2
SCHEMBL18434463 0.77 SLC40A1 (0.67) SLC40A1KDM4E
SCHEMBL18434840 0.76 SLC40A1 (0.53) SLC40A1KDM4EL3MBTL1
SCHEMBL18434682 0.75 SLC40A1 (0.50) SLC40A1KDM4EL3MBTL1METAP2
SCHEMBL18434821 0.74 SLC40A1 (0.64) SLC40A1KDM4EL3MBTL1
SCHEMBL11973661 0.73 SLC40A1 (1.00) SLC40A1
SCHEMBL18434678 0.72 SLC40A1 (0.57) SLC40A1KDM4EL3MBTL1METAP2

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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