SCHEMBL6564402

SCHEMBL6564402

CC(N)CC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ BCL9 O00512 1/20 0.61
▸ CTNNB1 P35222 1/20 0.61
▸ GAA P10253 1/20 0.53
▸ KMT2A Q03164 5/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ HTR2A P28223 1/20 0.50
▸ PTPN7 P35236 1/20 0.49
▸ PTPN12 Q05209 1/20 0.49
▸ PTPN22 Q9Y2R2 1/20 0.49
▸ PKM P14618 1/20 0.49
▸ MGLL Q99685 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ PTGS2 P35354 1/20 0.44
▸ HGFAC Q04756 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ HTT P42858 1/20 0.44

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
SCHEMBL14453837 0.88 BCL9 (0.65) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL14962749 0.84 BCL9 (0.60) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL19201779 0.81 BCL9 (0.65) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL5466190 0.80 BCL9 (0.56) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL515913 0.80 GAA (0.57) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL9435291 0.80 GAA (0.57) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL4076398 0.79 BCL9 (0.66) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL27675916 0.79 LMNA (0.50) GAAKMT2ANPC1MAPTALDH1A1
SCHEMBL2294100 0.79 BCL9 (0.76) BCL9CTNNB1GAAKMT2ASMN1; SMN2
SCHEMBL27713294 0.79 BCL9 (0.70) BCL9CTNNB1GAAKMT2ASMN1; 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
EP-1147076-B1 ACRYLAMIDE DERIVATIVES AND POLYMERS CONTAINING SAID DERIVATIVES OKANO TERUO PROF (JP) 2004-03-31 — — EP disclosed
US-6495645-B1 INCORPORATING MANY SIDE FUNCTIONAL GROUPS WHILE MAINTAINING SENSITIVE TEMPERATURE RESPONSE Okano, Terou (JP) 2002-12-17 — — US disclosed
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