SCHEMBL18434849

SCHEMBL18434849

c1ccc2c(c1)SNc1c-2cc(N2CCCC2)c2cccnc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 10/20 0.60
▸ MAPT P10636 5/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ METAP1 P53582 1/20 0.39
▸ TNNI3 P19429 1/20 0.39
▸ TNNT2 P45379 1/20 0.39
▸ TNNC1 P63316 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ HTT P42858 2/20 0.36
▸ MITF O75030 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CASP1 P29466 1/20 0.36
▸ HBB P68871 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ NCF1 P14598 2/20 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
SCHEMBL18434448 0.99 SLC40A1 (0.61) SLC40A1MAPTSMN1; SMN2METAP1TNNI3
SCHEMBL18434504 0.90 SLC40A1 (0.62) SLC40A1MAPTMETAP1MAPK1TSHR
SCHEMBL18434485 0.83 SLC40A1 (0.67) SLC40A1TDP1
SCHEMBL18434412 0.78 SLC40A1 (0.55) SLC40A1MAPTSMN1; SMN2METAP1ALDH1A1
SCHEMBL18434472 0.78 KDM4E (0.39) SLC40A1MAPTSMN1; SMN2METAP1ALDH1A1
SCHEMBL18434664 0.78 SLC40A1 (0.55) SLC40A1MAPTALDH1A1KDM4EL3MBTL1
SCHEMBL12475058 0.78 SLC40A1 (0.55) SLC40A1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL18434406 0.77 SLC40A1 (0.58) SLC40A1KDM4EMEN1KMT2A
SCHEMBL11973480 0.75 SLC40A1 (1.00) SLC40A1MAPTSMN1; SMN2ALDH1A1KDM4E
SCHEMBL18434689 0.75 SLC40A1 (0.52) SLC40A1MAPTSMN1; SMN2ALDH1A1KDM4E

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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