SCHEMBL11244747

SCHEMBL11244747

CCOc1ccc(NCC(=O)N(CC)CC)cc1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.60
CA1 P00915 2/20 0.60
CA2 P00918 2/20 0.60
CA9 Q16790 2/20 0.60
LMNA P02545 3/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
POLB P06746 2/20 0.54
CYP1A2 P05177 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 5/20 0.53
MAPT P10636 8/20 0.51
GAA P10253 2/20 0.51
HSP90AA1 P07900 1/20 0.51
HSP90AB1 P08238 1/20 0.51
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49

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
SCHEMBL30352517 0.85 LMNA (0.56) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL7976334 0.81 KMT2A (0.64) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL2454762 0.81 KMT2A (0.59) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL1041119 0.81 CA12 (0.65) CA12CA1CA2CA9KMT2A
SCHEMBL28565295 0.80 HTT (0.60) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL11258990 0.80 CA12 (0.62) CA12CA1CA2CA9LMNA
SCHEMBL9724941 0.79 MAPT (0.71) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL28468875 0.79 POLB (0.68) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL21980929 0.77 POLB (0.58) LMNAKMT2AMEN1POLBCYP1A2
SCHEMBL27890896 0.77 LMNA (0.54) LMNAKMT2AMEN1POLBCYP1A2

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-4310429-A HEAT AND OXIDATION RESISTANT AMINOACETAMIDES THE B. F. GOODRICH COMPANY (US) 1982-01-12 US disclosed
EP-0007182-A1 Stabilized polymers, novel stabilizers and synthesis thereof The B.F. GOODRICH Company (US) 1980-01-23 EP disclosed