SCHEMBL9269081

SCHEMBL9269081

O=C(Nc1ccc(F)cc1F)NC1CCC(c2ccccc2)(c2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.65
▸ NPC1 O15118 3/20 0.65
▸ POLB P06746 2/20 0.65
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ SMN1; SMN2 Q16637 2/20 0.54
▸ GAA P10253 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ HTT P42858 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ GRIN2B Q13224 1/20 0.48
▸ DRD2 P14416 1/20 0.48
▸ ADRA1D P25100 1/20 0.48
▸ ADRA1A P35348 1/20 0.48
▸ ADRA1B P35368 1/20 0.48
▸ PKM P14618 1/20 0.46
▸ PAK1 Q13153 1/20 0.46
▸ RECQL P46063 1/20 0.45
▸ EPHX2 P34913 2/20 0.45

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
SCHEMBL9275859 0.88 RAB9A (0.62) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL16866144 0.83 NPC1 (0.86) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL23573491 0.81 NPC1 (0.77) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL23573490 0.81 NPC1 (0.77) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL2750640 0.81 RAB9A (0.97) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL27267057 0.79 RAB9A (1.00) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL27264917 0.79 RAB9A (1.00) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL9270646 0.79 RAB9A (0.67) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL4983290 0.75 L3MBTL1 (0.76) RAB9ANPC1POLBL3MBTL1SMN1; SMN2
SCHEMBL9273863 0.74 NPC1 (0.70) RAB9ANPC1POLBL3MBTL1SMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5420164-A Enzyme inhibitors YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-05-30 — — US disclosed
EP-0507291-A1 Cyclohexylurea compounds YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1992-10-07 — — EP disclosed
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