SCHEMBL348045

SCHEMBL348045

CC(=O)OCC(=O)Nc1ccc(C=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.67
SMN1; SMN2 Q16637 5/20 0.58
HPGD P15428 3/20 0.58
MAPT P10636 2/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
PKM P14618 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 2/20 0.46
USP2 O75604 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
KLK7 P49862 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
SCHEMBL2282492 0.83 HPGD (0.65) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL14075485 0.81 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL13841454 0.81 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL10238819 0.80 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL16569387 0.80 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL6607271 0.80 ALDH1A1 (0.71) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL21177278 0.80 MAPT (0.59) ALDH1A1MAPTKDM4E
SCHEMBL4594156 0.80 SMN1; SMN2 (0.74) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL11273760 0.78 KDM4E (0.65) ALDH1A1SMN1; SMN2HPGDMAPTNPC1
SCHEMBL31558412 0.77 ALDH1A1 (0.67) ALDH1A1SMN1; SMN2HPGDMAPTNPC1

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-20120015905-A1 COMPOUNDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES RESVERLOGIX CORP. 2012-01-19 US disclosed
US-8053440-B2 Compounds for the prevention and treatment of cardiovascular diseases Resverlogix Corporation (CA) 2011-11-08 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 (1 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-20120015905-A1 COMPOUNDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASES APOB, HDLBP, FABP3 ALDH1A1 548/4885SMN1; SMN2 3476/4885HPGD 522/4885

“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.