SCHEMBL13041387

SCHEMBL13041387

CCC(=O)CC(=O)N1CCCC(C)C1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
LMNA P02545 1/20 0.63
KMT2A Q03164 4/20 0.62
MEN1 O00255 3/20 0.62
POLB P06746 3/20 0.62
MAPT P10636 1/20 0.62
SMN1; SMN2 Q16637 2/20 0.50
HPGD P15428 2/20 0.50
GAA P10253 1/20 0.48
HSD17B10 Q99714 1/20 0.48
RAB9A P51151 2/20 0.46
NPC1 O15118 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
RECQL P46063 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
SCHEMBL22474755 0.86 ALDH1A1 (0.71) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL15014489 0.86 ALDH1A1 (0.71) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL478307 0.86 ALDH1A1 (0.71) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL13931196 0.83 ALDH1A1 (0.67) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL3741164 0.82 MEN1 (0.69) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL15224143 0.81 ALDH1A1 (0.65) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL19240755 0.81 ALDH1A1 (0.64) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL15613653 0.79 KMT2A (0.81) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL8414529 0.79 KMT2A (0.81) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL10274487 0.79 KMT2A (0.81) ALDH1A1LMNAKMT2AMEN1POLB

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100280034-A1 Modulation of pathogenicity QUONOVA, LLC 2010-11-04 US disclosed
US-7338969-B2 Modulation of pathogenicity QUONOVA, LLC (US) 2008-03-04 US disclosed
US-20070208012-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-09-06 US disclosed
US-20070203128-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-30 US disclosed
US-20070196340-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-23 US disclosed
US-20070197492-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-23 US disclosed
US-20070184014-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-08-09 US disclosed
US-20070093534-A1 Modulation of Pathogenicity QUONOVA, LLC 2007-04-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070197492-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS ALDH1A1 4721/4885LMNA 2846/4885KMT2A 4236/4885
US-20070203128-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS ALDH1A1 4721/4885LMNA 2846/4885KMT2A 4236/4885
US-20070093534-A1 Modulation of Pathogenicity NR1H4, NR1I3, NR1H2 ALDH1A1 3931/4885LMNA 3949/4885KMT2A 2108/4885
US-20070208012-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS ALDH1A1 4721/4885LMNA 2846/4885KMT2A 4236/4885
US-20100280034-A1 Modulation of pathogenicity NR1H4, NR1I3, NR1H2 ALDH1A1 3931/4885LMNA 3949/4885KMT2A 2108/4885
US-20070184014-A1 Modulation of Pathogenicity ANTXR2, Q6ZSR9, PGLS ALDH1A1 4721/4885LMNA 2846/4885KMT2A 4236/4885
US-20070196340-A1 Modulation of Pathogenicity NR1H4, NR1I3, NR1H2 ALDH1A1 3931/4885LMNA 3949/4885KMT2A 2108/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.