SCHEMBL18434485

SCHEMBL18434485

CN(C)CCN1CCN(c2cc3c(c4ncccc24)NSc2ccccc2-3)CC1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 9/20 0.67
▸ SIRT6 Q8N6T7 1/20 0.40
▸ BRD1 O95696 1/20 0.38
▸ TAF1 P21675 1/20 0.38
▸ BRPF1 P55201 1/20 0.38
▸ DRD2 P14416 3/20 0.37
▸ DRD3 P35462 2/20 0.37
▸ TDP1 Q9NUW8 1/20 0.36
▸ MAPK14 Q16539 1/20 0.35
▸ ELANE P08246 1/20 0.35
▸ HTR1A P08908 2/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ KDM1A O60341 1/20 0.34

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
SCHEMBL18434849 0.83 SLC40A1 (0.60) SLC40A1TDP1
SCHEMBL18434448 0.82 SLC40A1 (0.61) SLC40A1TDP1
SCHEMBL18434504 0.80 SLC40A1 (0.62) SLC40A1
SCHEMBL18434621 0.80 SLC40A1 (0.65) SLC40A1SIRT6BRD1TAF1BRPF1
SCHEMBL11973086 0.80 SLC40A1 (1.00) SLC40A1
SCHEMBL18434855 0.76 SLC40A1 (0.62) SLC40A1TDP1
SCHEMBL18434500 0.75 SLC40A1 (0.63) SLC40A1
SCHEMBL18434824 0.75 SLC40A1 (0.63) SLC40A1DRD2
SCHEMBL18434714 0.71 SLC40A1 (0.66) SLC40A1
SCHEMBL18434697 0.71 SLC40A1 (0.67) 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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