SCHEMBL8260422

SCHEMBL8260422

CNC(=O)COc1ccc(F)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
GAA P10253 1/20 0.59
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
HPGD P15428 4/20 0.54
NPC1 O15118 1/20 0.54
TP53 P04637 1/20 0.54
ALOX15 P16050 1/20 0.54
RAB9A P51151 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
ALDH1A1 P00352 4/20 0.53
POLB P06746 1/20 0.53
MAPT P10636 1/20 0.53
PKM P14618 1/20 0.52
RECQL P46063 1/20 0.52
HTT P42858 1/20 0.52
KDM4E B2RXH2 1/20 0.50
THRB P10828 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL4426846 0.91 MAOB (0.61) LMNAGAAMEN1KMT2ASMN1; SMN2
SCHEMBL13916156 0.83 KMT2A (0.54) LMNAMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL1257639 0.83 LMNA (0.63) LMNAGAAMEN1KMT2ASMN1; SMN2
SCHEMBL17775464 0.83 ALOX15 (0.59) MEN1KMT2ASMN1; SMN2NPC1ALOX15
SCHEMBL4427417 0.83 PKM (0.54) MEN1KMT2ASMN1; SMN2ALDH1A1MAPT
SCHEMBL171840 0.83 MEN1 (0.61) GAAMEN1KMT2ASMN1; SMN2HPGD
SCHEMBL1303739 0.81 ALDH1A1 (0.68) LMNAGAAMEN1KMT2ASMN1; SMN2
SCHEMBL15300921 0.81 ALDH1A1 (0.67) MEN1KMT2ASMN1; SMN2ALDH1A1POLB
SCHEMBL14949145 0.81 PTGS2 (0.55) MEN1KMT2ASMN1; SMN2HPGDL3MBTL1
SCHEMBL26345903 0.81 LMNA (0.61) LMNAGAAMEN1KMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7365196-B2 Sulphonamido-substituted bridged bicycloalkyl derivatives MERCK SHARP & DOHME LTD. (GB) 2008-04-29 US disclosed
US-7365196-B2 Sulphonamido-substituted bridged bicycloalkyl derivatives MERCK SHARP & DOHME LTD. (GB) 2008-04-29 US disclosed
WO-2006067224-A2 SPIRO-BENZODIOXOLE AND SPIRO-BENZODIOXANE COMPOUNDS AS OREXIN RECEPTOR ANTAGONISTS BIOVITRUM AB (PUBL) (SE) 2006-06-29 WO disclosed