SCHEMBL18434660

SCHEMBL18434660

[O-][S+]1Nc2c(cc(F)c3cccnc23)-c2ccccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC40A1 Q9NP59 13/20 0.53
▸ KDM4E B2RXH2 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ TDO2 P48775 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BLM P54132 1/20 0.38
▸ CASP6 P55212 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MPI P34949 1/20 0.36
▸ CDC7 O00311 1/20 0.33
▸ ROCK2 O75116 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
SCHEMBL18434688 0.85 SLC40A1 (0.53) SLC40A1KDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL18434491 0.83 SLC40A1 (0.58) SLC40A1KDM4EL3MBTL1TDO2MEN1
SCHEMBL18434678 0.80 SLC40A1 (0.57) SLC40A1KDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL18434854 0.78 SLC40A1 (0.59) SLC40A1KDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL18434505 0.76 SLC40A1 (0.60) SLC40A1MAPTCDK2
SCHEMBL18434666 0.76 SLC40A1 (0.55) SLC40A1KDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL18434842 0.73 SLC40A1 (0.52) SLC40A1IDO1PIM1
SCHEMBL18434791 0.73 SLC40A1 (0.52) SLC40A1KDM4EL3MBTL1MEN1ALDH1A1
SCHEMBL18434816 0.72 SLC40A1 (0.55) SLC40A1TDP1CDC7MAP4K4PIM1
SCHEMBL18434454 0.72 SLC40A1 (0.53) SLC40A1KDM4EL3MBTL1MEN1ALDH1A1

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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