SCHEMBL20385092

SCHEMBL20385092

NN/N=C(\Nc1ccccc1F)c1ccccc1I

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.41
▸ RAB9A P51151 5/20 0.41
▸ NPC1 O15118 3/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ POLB P06746 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ SIGMAR1 Q99720 2/20 0.35
▸ GRIN2D O15399 1/20 0.35
▸ GRIN3B O60391 1/20 0.35
▸ GRIN1 Q05586 1/20 0.35
▸ GRIN2A Q12879 1/20 0.35
▸ GRIN2B Q13224 1/20 0.35
▸ GRIN2C Q14957 1/20 0.35
▸ GRIN3A Q8TCU5 1/20 0.35
▸ ALDH1A1 P00352 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
SCHEMBL20385093 0.87 HDAC1 (0.41) RAB9ANPC1KMT2AMEN1SIGMAR1
SCHEMBL20385134 0.85 POLB (0.43) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL20385112 0.84 GAA (0.46) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL20385119 0.82 CYP1A2 (0.47) RAB9ANPC1KMT2AMEN1LMNA
SCHEMBL20385148 0.82 HTT (0.44) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL20385122 0.79 HTT (0.41) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL20385111 0.79 KMT2A (0.48) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL20385085 0.79 HTT (0.42) HTTRAB9ANPC1SMN1; SMN2POLB
SCHEMBL20385088 0.79 HTT (0.46) HTTRAB9ASMN1; SMN2POLBKMT2A
SCHEMBL20385160 0.78 HTT (0.41) HTTRAB9ANPC1SMN1; SMN2POLB

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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