SCHEMBL18434497

SCHEMBL18434497

Clc1cc2c(c3ncccc13)NSc1ccc(N3CCOCC3)cc1-2

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 7/20 0.65
▸ METAP2 P50579 1/20 0.42
▸ RAB9A P51151 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ PIK3R2 O00459 8/20 0.39
▸ PIK3CD O00329 1/20 0.38
▸ PIK3R1 P27986 1/20 0.38
▸ PIK3CA P42336 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ PAX8 Q06710 1/20 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) SLC40A1METAP2RAB9AKDM4ELMNA
SCHEMBL18434841 0.88 SLC40A1 (0.52) SLC40A1METAP2RAB9AKDM4ELMNA
SCHEMBL18434473 0.82 SLC40A1 (0.68) SLC40A1METAP2KDM4ELMNAMAPT
SCHEMBL18434703 0.80 SLC40A1 (0.69) SLC40A1METAP2RAB9AKDM4EHSP90AA1
SCHEMBL11973440 0.78 SLC40A1 (1.00) SLC40A1
SCHEMBL18434845 0.77 SLC40A1 (0.58) SLC40A1METAP2KDM4ELMNAHSP90AA1
SCHEMBL18434504 0.77 SLC40A1 (0.62) SLC40A1MAPTPIK3R2PIK3CDPIK3CA
SCHEMBL18434412 0.77 SLC40A1 (0.55) SLC40A1METAP2KDM4ELMNAHSP90AA1
SCHEMBL18434496 0.75 SLC40A1 (0.61) SLC40A1KDM4ELMNAHSP90AA1MAPT
SCHEMBL18434673 0.75 SLC40A1 (0.44) SLC40A1METAP2KDM4ELMNAHSP90AA1

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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