SCHEMBL12474964

SCHEMBL12474964

O=S1(=O)Nc2c(ccc3cc(Br)cnc23)-c2ccccc21

nearest known ligand 0.73

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ NFKBIA P25963 5/20 0.73
▸ RELA Q04206 5/20 0.69
▸ SLC40A1 Q9NP59 17/20 0.64
▸ TDP1 Q9NUW8 2/20 0.64
▸ KDM4E B2RXH2 1/20 0.64
▸ MEN1 O00255 1/20 0.64
▸ ALDH1A1 P00352 1/20 0.64
▸ LMNA P02545 1/20 0.64
▸ MAPT P10636 1/20 0.64
▸ ALOX15 P16050 1/20 0.64
▸ TSHR P16473 1/20 0.64
▸ OPRK1 P41145 1/20 0.64
▸ HTT P42858 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ SMN1; SMN2 Q16637 1/20 0.64
▸ NPSR1 Q6W5P4 1/20 0.64
▸ HSD17B10 Q99714 1/20 0.64
▸ L3MBTL1 Q9Y468 1/20 0.64

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
SCHEMBL11973195 0.79 SLC40A1 (1.00) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL11973330 0.73 SLC40A1 (1.00) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL11972877 0.73 SLC40A1 (1.00) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL11973557 0.71 SLC40A1 (0.68) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL11972942 0.70 SLC40A1 (0.59) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL29407003 0.70 CCR1 (0.52) TDP1KDM4EMEN1ALDH1A1LMNA
SCHEMBL557234 0.70 CCR1 (0.52) TDP1KDM4EMEN1ALDH1A1LMNA
SCHEMBL27176712 0.70 CA12 (0.56) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL11973307 0.69 SLC40A1 (1.00) NFKBIARELASLC40A1TDP1KDM4E
SCHEMBL12474874 0.69 SLC40A1 (0.67) NFKBIARELASLC40A1TDP1KDM4E

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
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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