SCHEMBL18434820

SCHEMBL18434820

CNCCN1CCN(c2cc3c(c4ncccc24)N[S+]([O-])c2ccccc2-3)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 7/20 0.49
▸ TLR9 Q9NR96 1/20 0.35
▸ HTR1A P08908 3/20 0.34
▸ ADRA1A P35348 2/20 0.34
▸ DRD2 P14416 2/20 0.34
▸ HTR2A P28223 1/20 0.34
▸ HTR7 P34969 1/20 0.34
▸ HTR6 P50406 1/20 0.34
▸ DRD3 P35462 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ CARM1 Q86X55 2/20 0.34
▸ APP P05067 1/20 0.33
▸ BCHE P06276 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ USP2 O75604 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CASP1 P29466 1/20 0.33

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
SCHEMBL18434621 0.88 SLC40A1 (0.65) SLC40A1HTR1ADRD2DRD3SLC6A4
SCHEMBL18434854 0.83 SLC40A1 (0.59) SLC40A1MEN1CASP1KMT2ASMN1; SMN2
SCHEMBL18434505 0.81 SLC40A1 (0.60) SLC40A1
SCHEMBL18434712 0.78 SLC40A1 (0.64) SLC40A1MEN1USP2LMNACASP7
SCHEMBL18434692 0.75 SLC40A1 (0.67) SLC40A1APP
SCHEMBL18434660 0.71 SLC40A1 (0.53) SLC40A1MEN1LMNAKMT2A
SCHEMBL18434688 0.71 SLC40A1 (0.53) SLC40A1MEN1USP2LMNAKMT2A
SCHEMBL18434485 0.67 SLC40A1 (0.67) SLC40A1HTR1ADRD2DRD3SLC6A4
SCHEMBL18434701 0.67 SLC40A1 (0.67) SLC40A1USP2CASP7SMN1; SMN2
SCHEMBL11973086 0.66 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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