SCHEMBL1244089

SCHEMBL1244089

CCC(Oc1ccc(SCC=C(c2ccc(C#Cc3ccccc3)cc2)c2ccc(C#Cc3ccccc3)cc2)cc1C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 13/20 0.50
PPARA Q07869 11/20 0.47
PPARG P37231 9/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP12 P39900 1/20 0.37
MMP14 P50281 1/20 0.37
MMP15 P51511 1/20 0.37
MMP16 P51512 1/20 0.37
MMP26 Q9NRE1 1/20 0.37
PTGDR2 Q9Y5Y4 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
SCHEMBL1246172 0.91 PPARD (0.46) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1245381 0.90 PPARD (0.48) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1244055 0.88 PPARD (0.46) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1245291 0.88 PPARD (0.46) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1245883 0.86 PPARD (0.53) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1245339 0.86 PPARD (0.44) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1246265 0.84 PPARD (0.46) PPARDPPARAPPARGMMP2
SCHEMBL3021753 0.84 PPARD (0.48) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL3021757 0.84 PPARD (0.48) PPARDPPARAPPARGSMN1; SMN2PTGDR2
SCHEMBL1244159 0.83 PPARD (0.42) PPARDPPARAPPARGSMN1; SMN2PTGDR2

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-20110039841-A1 Novel compounds, their preparation and use NOVO NORDISK A/S (DK) 2011-02-17 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-20110039841-A1 Novel compounds, their preparation and use PPARG, PPARD, PPARA PPARD 2/4885PPARA 3/4885PPARG 1/4885

“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.