SCHEMBL15043693

SCHEMBL15043693

CC(=O)CC1CCC(CC(C)=O)CCC(CC(C)=O)CCC(CC(C)=O)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPA P38571 1/20 0.38
ALDH1A1 P00352 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
NAMPT P43490 1/20 0.36
AKR1C3 P42330 1/20 0.36
TRPA1 O75762 1/20 0.35
EPHX1 P07099 1/20 0.34
HPGD P15428 1/20 0.34
KMT2A Q03164 1/20 0.34
ANPEP P15144 1/20 0.34
ENPEP Q07075 1/20 0.34
PLG P00747 1/20 0.33
PLAT P00750 1/20 0.33
LMNA P02545 1/20 0.33
ALOX5 P09917 1/20 0.33
SLC1A3 P43003 2/20 0.31
SLC1A2 P43004 2/20 0.31
SLC1A1 P43005 2/20 0.31
THRA P10827 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL526891 1.00
SCHEMBL14576723 1.00 LIPA (0.38) LIPAALDH1A1TDP1NAMPTAKR1C3
SCHEMBL15043694 0.92 KMT2A (0.40) LIPAALDH1A1TDP1NAMPTAKR1C3
SCHEMBL10174290 0.89 NAMPT (0.36) LIPAALDH1A1TDP1NAMPTAKR1C3
SCHEMBL15445405 0.89 ANPEP (0.47) ALDH1A1TDP1ANPEPENPEPPLG
SCHEMBL12424289 0.89 ESR1 (0.33) LIPAALDH1A1TDP1NAMPTAKR1C3
SCHEMBL15067035 0.89 EPHX2 (0.36) LIPAALDH1A1TDP1NAMPTAKR1C3
SCHEMBL156237 0.88
SCHEMBL1396131 0.88
SCHEMBL23168695 0.87 PLG (0.52) LIPATDP1NAMPTAKR1C3ANPEP

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
US-20130156851-A1 LIPOMACROCYCLES AND USES THEREOF AGAVE PHARMA, INCORPORATED 2013-06-20 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-20130156851-A1 LIPOMACROCYCLES AND USES THEREOF LIPC, LIPA, LIPE LIPA 2/4885ALDH1A1 2845/4885TDP1 4612/4885

“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.