SCHEMBL6498674

SCHEMBL6498674

COc1ccc(COCCCCCCC/C(CC(=O)O)=C(\C)CC(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
FFAR1 O14842 3/20 0.45
TBXAS1 P24557 4/20 0.45
KDM4E B2RXH2 1/20 0.42
HTT P42858 1/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
F2RL1 P55085 1/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL1008295 0.84 L3MBTL1 (0.62) L3MBTL1TDP1FFAR1TBXAS1KDM4E
SCHEMBL6498671 0.76 L3MBTL1 (0.52) L3MBTL1TDP1FFAR1TBXAS1KDM4E
SCHEMBL28644740 0.73 RAB9A (0.71) L3MBTL1TDP1HTTNPC1POLB
SCHEMBL16614410 0.72 L3MBTL1 (0.65) L3MBTL1TDP1HTTNPC1POLB
SCHEMBL1009895 0.72 L3MBTL1 (0.65) L3MBTL1TDP1HTTNPC1POLB
SCHEMBL6551488 0.72 L3MBTL1 (0.65) L3MBTL1TDP1HTTNPC1POLB
SCHEMBL11196123 0.72 SMN1; SMN2 (0.51) L3MBTL1TDP1FFAR1KDM4EHTT
SCHEMBL27089915 0.72 L3MBTL1 (0.65) L3MBTL1TDP1HTTNPC1POLB
SCHEMBL1005774 0.71 L3MBTL1 (0.45) L3MBTL1TDP1TBXAS1ALDH1A1
SCHEMBL16614396 0.71 L3MBTL1 (0.67) L3MBTL1TDP1

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-6861432-B2 Piperazine derivatives that destabilize androgen receptors SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-01 US disclosed
US-20040009969-A1 Piperazine derivatives that destabilize androgen receptors SCHERING AG (DE) 2004-01-15 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-20040009969-A1 Piperazine derivatives that destabilize androgen receptors AR, FSHR, GNRHR L3MBTL1 4567/4885TDP1 4281/4885FFAR1 20/4885

“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.