SCHEMBL20385086

SCHEMBL20385086

NN/N=C(\Nc1ccccc1F)c1ccccc1-c1ccccc1OCC(N)=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNN4 O15554 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ NPC1 O15118 4/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ GAA P10253 1/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35

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
SCHEMBL20385159 0.90 KCNN4 (0.45) KCNN4HTTKDM4EALDH1A1NPC1
SCHEMBL20385150 0.87 ALDH1A1 (0.38) KCNN4HTTKDM4EALDH1A1NPC1
SCHEMBL20385143 0.84 KCNN4 (0.41) KCNN4HTTKDM4EALDH1A1NPC1
SCHEMBL20385149 0.83 ALDH1A1 (0.38) HTTKDM4EALDH1A1NPC1RAB9A
SCHEMBL20385147 0.82 HPGD (0.48) HTTKDM4EALDH1A1NPC1RAB9A
SCHEMBL20385148 0.80 HTT (0.44) HTTKDM4EALDH1A1NPC1RAB9A
SCHEMBL20385157 0.80 NPC1 (0.40) HTTKDM4EALDH1A1NPC1RAB9A
SCHEMBL20385085 0.77 HTT (0.42) HTTKDM4EALDH1A1NPC1RAB9A
SCHEMBL20385160 0.76 HTT (0.41) HTTKDM4EALDH1A1NPC1RAB9A
SCHEMBL20385132 0.75 HPGD (0.48) HTTKDM4EALDH1A1NPC1RAB9A

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-2867215-B1 TETRAZOLE DERIVATIVES AND THEIR USE AS POTASSIUM CHANNEL MODULATORS SANIONA AS (DK) 2018-07-18 — — EP disclosed
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