SCHEMBL6715217

SCHEMBL6715217

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

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 1/20 0.45
PPARA Q07869 10/20 0.44
PPARG P37231 6/20 0.42
PPARD Q03181 4/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
ABCB11 O95342 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
TSHR P16473 1/20 0.38
HTR2A P28223 1/20 0.38
PMP22 Q01453 1/20 0.38
TP53 P04637 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL6722312 0.89 PPARA (0.54) OPRK1PPARAPPARGPPARD
SCHEMBL6713537 0.86 OPRK1 (0.49) OPRK1PPARAPPARGPPARDNPC1
SCHEMBL6715972 0.85 OPRK1 (0.48) OPRK1PPARAPPARGPPARDNPC1
SCHEMBL6715183 0.82 OPRK1 (0.53) OPRK1PPARAPPARGPPARDNPC1
SCHEMBL6713362 0.81 RXRA (0.55) OPRK1PPARAPPARGNPC1RAB9A
SCHEMBL6718042 0.80 CA12 (0.47) OPRK1PPARAPPARGPPARDNPC1
SCHEMBL6714812 0.79 KMT2A (0.48) OPRK1PPARAPPARGPPARDNPC1
SCHEMBL6722304 0.78 PPARA (0.45) PPARAPPARGPPARDNPC1RAB9A
SCHEMBL6717544 0.75 PPARA (0.46) PPARAPPARGPPARDCYP1A2SMN1; SMN2
SCHEMBL6714997 0.74 PPARA (0.58) OPRK1PPARAPPARGPPARD

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 OPRK1 752/4885PPARA 71/4885PPARG 23/4885

“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.