SCHEMBL18434683

SCHEMBL18434683

CCOc1ccc2c(c1)-c1cc(Cl)c3cccnc3c1NS2

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 13/20 0.62
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HSP90AA1 P07900 2/20 0.39
▸ ADAM17 P78536 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ CCR1 P32246 1/20 0.39
▸ CCR8 P51685 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ ALOX15B O15296 1/20 0.36
▸ NR1I2 O75469 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ MAPT P10636 1/20 0.36

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
SCHEMBL18434709 0.81 SLC40A1 (0.65) SLC40A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL18434845 0.81 SLC40A1 (0.58) SLC40A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL18434673 0.80 SLC40A1 (0.44) SLC40A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL18434412 0.80 SLC40A1 (0.55) SLC40A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL18434464 0.80 SLC40A1 (0.55) SLC40A1L3MBTL1CCR1CCR8
SCHEMBL18434808 0.78 SLC40A1 (0.51) SLC40A1
SCHEMBL18434496 0.78 SLC40A1 (0.61) SLC40A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL18434655 0.78 SLC40A1 (0.66) SLC40A1L3MBTL1ALDH1A1CCR1CCR8
SCHEMBL18434680 0.77 SLC40A1 (0.58) SLC40A1MEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL11973468 0.77 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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