SCHEMBL27368695

SCHEMBL27368695

CC(C)N(Cc1cccnc1)C(=O)CC(N)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.56
▸ MEN1 O00255 2/20 0.56
▸ FNTA P49354 1/20 0.54
▸ FNTB P49356 1/20 0.54
▸ GAA P10253 1/20 0.49
▸ LMNA P02545 1/20 0.48
▸ RECQL P46063 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ CHRNB2 P17787 2/20 0.46
▸ CHRNA4 P43681 2/20 0.46
▸ ADAMTS4 O75173 1/20 0.46
▸ PSMB5 P28074 4/20 0.45
▸ MMP2 P08253 1/20 0.45
▸ MMP9 P14780 1/20 0.45
▸ MMP8 P22894 1/20 0.45
▸ MMP13 P45452 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 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
SCHEMBL27914432 0.80 RECQL (0.53) KMT2ALMNARECQLALDH1A1CHRNB2
SCHEMBL9843954 0.78 SOAT1 (0.47) KMT2AMEN1FNTAFNTBGAA
SCHEMBL22260765 0.77 GAA (0.48) KMT2AMEN1FNTAFNTBGAA
Hydrochloric Acid SCHEMBL22372373 0.76 GAA (0.47) KMT2AMEN1FNTAFNTBGAA
SCHEMBL13829049 0.75 FNTA (0.48) KMT2AFNTAFNTBGAALMNA
SCHEMBL14454647 0.75 LMNA (0.53) FNTAFNTBGAALMNAALDH1A1
SCHEMBL10752178 0.74 LMNA (0.47) KMT2AMEN1FNTAFNTBGAA
SCHEMBL8470996 0.72 RIPK1 (0.62) KMT2ALMNARECQLALDH1A1CHRNB2
SCHEMBL27771997 0.71 CHRNB2 (0.59) LMNAALDH1A1CHRNB2CHRNA4CYP1A2
SCHEMBL25203986 0.71 LMNA (0.55) KMT2AMEN1FNTAFNTBGAA

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
CN-1051733-A Acyl-CoA: cholesteryl transferase inhibitor WARNER LAMBERT CO (US) 1991-05-29 — — CN disclosed
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