SCHEMBL18434412

SCHEMBL18434412

Clc1cc2c(c3ncccc13)NSc1ccccc1-2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 14/20 0.55
▸ CCR1 P32246 1/20 0.48
▸ CCR8 P51685 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.43
▸ MMP14 P50281 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ LMNA P02545 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ HSP90AA1 P07900 2/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ ALOX15 P16050 2/20 0.43
▸ ALOX12 P18054 2/20 0.43
▸ SLC6A2 P23975 2/20 0.43
▸ OPRK1 P41145 2/20 0.43
▸ HTT P42858 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL18434845 0.85 SLC40A1 (0.58) SLC40A1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL12475058 0.84 SLC40A1 (0.55) SLC40A1L3MBTL1ALDH1A1KDM4EMEN1
SCHEMBL18434664 0.84 SLC40A1 (0.55) SLC40A1L3MBTL1ALDH1A1KDM4EMEN1
SCHEMBL18434472 0.84 KDM4E (0.39) SLC40A1L3MBTL1ALDH1A1MMP14KDM4E
SCHEMBL18434792 0.83 SLC40A1 (0.55) SLC40A1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL18434680 0.83 SLC40A1 (0.58) SLC40A1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL18434806 0.82 SLC40A1 (0.58) SLC40A1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL18434673 0.82 SLC40A1 (0.44) SLC40A1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL18434496 0.82 SLC40A1 (0.61) SLC40A1CCR1CCR8L3MBTL1ALDH1A1
SCHEMBL18434406 0.81 SLC40A1 (0.58) SLC40A1KDM4EMEN1KMT2A

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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