SCHEMBL8568154

SCHEMBL8568154

CNC(=O)c1cc(C)nc2ccccc12

nearest known ligand 0.73

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.73
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
SMN1; SMN2 Q16637 2/20 0.66
RAB9A P51151 2/20 0.64
NPC1 O15118 1/20 0.63
HCRTR1 O43613 1/20 0.62
HTT P42858 2/20 0.61
ALDH1A1 P00352 2/20 0.61
GAA P10253 1/20 0.61
KDM4E B2RXH2 1/20 0.61
LMNA P02545 1/20 0.60

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
SCHEMBL5815673 0.86 L3MBTL1 (0.71) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL28915977 0.83 L3MBTL1 (0.68) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL12903055 0.83 MEN1 (0.73) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL29727186 0.83 L3MBTL1 (0.67) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL29727188 0.83 L3MBTL1 (0.67) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL1305492 0.83 L3MBTL1 (0.67) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL31435202 0.83 HTT (0.71) L3MBTL1MEN1KMT2ARAB9ANPC1
SCHEMBL28234816 0.82 L3MBTL1 (0.61) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL30978278 0.81 L3MBTL1 (0.69) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A
SCHEMBL13209744 0.81 L3MBTL1 (0.69) L3MBTL1MEN1KMT2ASMN1; SMN2RAB9A

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
US-5846990-A Substituted biphenyl isoxazole sulfonamides BRISTOL-MYERS SQUIBB CO. (US) 1998-12-08 US claimed