SCHEMBL6714812

SCHEMBL6714812

CCOC(=O)C(C)(Cc1ccc(OCCOC2CCCCO2)cc1)Oc1ccc(C(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
MEN1 O00255 3/20 0.48
PPARA Q07869 8/20 0.43
PPARG P37231 8/20 0.41
PPARD Q03181 5/20 0.41
OPRK1 P41145 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 1/20 0.36
ALDH1A1 P00352 1/20 0.36
KDM4E B2RXH2 2/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL6718079 0.90 PPARA (0.53) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6713421 0.82 KMT2A (0.47) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6713537 0.81 OPRK1 (0.49) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6715972 0.80 OPRK1 (0.48) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6715187 0.79 MEN1 (0.50) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6715217 0.79 OPRK1 (0.45) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6715183 0.77 OPRK1 (0.53) PPARAPPARGPPARDOPRK1NPC1
SCHEMBL6718042 0.76 CA12 (0.47) PPARAPPARGPPARDOPRK1NPC1
SCHEMBL6715028 0.76 MEN1 (0.48) KMT2AMEN1PPARAPPARGPPARD
SCHEMBL6713362 0.75 RXRA (0.55) PPARAPPARGOPRK1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040006141-A1 Amidocarboxylic acid compounds SANKYO COMPANY, LTD (JP) 2004-01-08 US disclosed
US-6528525-B1 Amidocarboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-03-04 US disclosed
EP-1026149-A1 AMIDOCARBOXYLIC ACID DERIVATIVES Sankyo Company Limited (JP) 2000-08-09 EP 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-20040006141-A1 Amidocarboxylic acid compounds NR1H2, AGK, APOL1 KMT2A 3611/4885MEN1 3916/4885PPARA 71/4885

“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.