SCHEMBL20385135

SCHEMBL20385135

N/N=C(\Nc1ccccc1F)c1ccccc1-c1ccccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ HTT P42858 5/20 0.43
▸ POLB P06746 4/20 0.41
▸ CA1 P00915 3/20 0.41
▸ CA2 P00918 3/20 0.41
▸ CA9 Q16790 3/20 0.41
▸ CA12 O43570 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ USP2 O75604 1/20 0.39
▸ MAPT P10636 3/20 0.38
▸ RECQL P46063 1/20 0.38
▸ CA4 P22748 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ GAA P10253 1/20 0.37

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
SCHEMBL20385152 0.90 HTT (0.47) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385085 0.86 HTT (0.42) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385115 0.86 HTT (0.43) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385154 0.84 HTT (0.43) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385161 0.84 HTT (0.43) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL16919552 0.84 HTT (0.47) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385133 0.82 HTT (0.41) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385156 0.82 HTT (0.41) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385153 0.82 HTT (0.44) NPC1RAB9ASMN1; SMN2HTTPOLB
SCHEMBL20385151 0.82 HTT (0.41) NPC1RAB9ASMN1; SMN2HTTPOLB

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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