SCHEMBL12475058

SCHEMBL12475058

Brc1cc2c(c3ncccc13)NSc1ccccc1-2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 11/20 0.55
▸ HTT P42858 5/20 0.47
▸ MEN1 O00255 5/20 0.47
▸ KMT2A Q03164 5/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ TDP1 Q9NUW8 3/20 0.47
▸ TP53 P04637 2/20 0.47
▸ HSP90AA1 P07900 2/20 0.47
▸ USP2 O75604 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.37
▸ MAPT P10636 4/20 0.37
▸ APAF1 O14727 1/20 0.37
▸ TDP2 O95551 1/20 0.37
▸ CASP3 P42574 1/20 0.37
▸ SENP8 Q96LD8 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP6 Q9GZR1 1/20 0.37
▸ NPSR1 Q6W5P4 4/20 0.34
▸ RXFP1 Q9HBX9 2/20 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
SCHEMBL18434664 0.84 SLC40A1 (0.55) SLC40A1MEN1KMT2AKDM4ETDP1
SCHEMBL18434412 0.84 SLC40A1 (0.55) SLC40A1HTTMEN1KMT2AKDM4E
SCHEMBL18434472 0.84 KDM4E (0.39) SLC40A1HTTMEN1KMT2AKDM4E
SCHEMBL11973692 0.81 SLC40A1 (0.48) SLC40A1
SCHEMBL18434406 0.81 SLC40A1 (0.58) SLC40A1MEN1KMT2AKDM4E
SCHEMBL11973826 0.80 KDM4E (0.46) SLC40A1KDM4EL3MBTL1RAB9A
SCHEMBL18434707 0.79 SLC40A1 (0.59) SLC40A1MEN1KMT2AKDM4EALDH1A1
SCHEMBL18434437 0.79 SLC40A1 (0.52) SLC40A1HTTMEN1KMT2AKDM4E
SCHEMBL18434849 0.78 SLC40A1 (0.60) SLC40A1HTTMEN1KMT2AKDM4E
SCHEMBL18434448 0.77 SLC40A1 (0.61) SLC40A1HTTMEN1KMT2AKDM4E

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 3 patents. 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
EP-2675526-A1 NOVEL SULFONAMINOQUINOLINE HEPCIDIN ANTAGONISTS Vifor (International) AG (CH) 2013-12-25 — — EP disclosed
WO-2012110603-A1 NOVEL SULFONAMINOQUINOLINE HEPCIDIN ANTAGONISTS VIFOR (INTERNATIONAL) AG (CH) 2012-08-23 — — WO disclosed
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