SCHEMBL18434841

SCHEMBL18434841

CN1CCN(c2ccc3c(c2)-c2cc(Cl)c4cccnc4c2NS3)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 9/20 0.52
▸ METAP2 P50579 1/20 0.42
▸ HTR6 P50406 1/20 0.40
▸ HSP90AA1 P07900 5/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ PPP1CA P62136 1/20 0.39
▸ PSMD14 O00487 1/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ALK Q9UM73 1/20 0.38
▸ MEN1 O00255 2/20 0.38

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
SCHEMBL18434689 0.90 SLC40A1 (0.52) SLC40A1METAP2HSP90AA1KDM4EKMT2A
SCHEMBL18434497 0.88 SLC40A1 (0.65) SLC40A1METAP2HSP90AA1KDM4EKMT2A
SCHEMBL18434773 0.82 SLC40A1 (0.59) SLC40A1METAP2KDM4ELMNAHTT
SCHEMBL11973602 0.79 SLC40A1 (0.81) SLC40A1
SCHEMBL18434845 0.77 SLC40A1 (0.58) SLC40A1METAP2HSP90AA1KDM4EKMT2A
SCHEMBL18434673 0.77 SLC40A1 (0.44) SLC40A1METAP2HSP90AA1KDM4EKMT2A
SCHEMBL18434412 0.77 SLC40A1 (0.55) SLC40A1METAP2HSP90AA1KDM4EKMT2A
SCHEMBL18434683 0.75 SLC40A1 (0.62) SLC40A1HSP90AA1KDM4EKMT2ALMNA
SCHEMBL18434496 0.75 SLC40A1 (0.61) SLC40A1HSP90AA1KDM4EKMT2ALMNA
SCHEMBL18434680 0.74 SLC40A1 (0.58) SLC40A1METAP2HSP90AA1KDM4EKMT2A

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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