SCHEMBL5050176

SCHEMBL5050176

CCCOc1cc(O)cc(CC(=O)OC)c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HSP90AB1 P08238 1/20 0.65
▸ CNR2 P34972 17/20 0.45
▸ CNR1 P21554 16/20 0.45
▸ SLC5A1 P13866 1/20 0.43
▸ SLC5A2 P31639 1/20 0.43

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
SCHEMBL5050245 0.93 HSP90AB1 (0.63) HSP90AB1CNR2CNR1
SCHEMBL5051707 0.88 HSP90AB1 (0.69) HSP90AB1CNR2CNR1SLC5A1SLC5A2
SCHEMBL9202392 0.84 HSP90AB1 (0.69) HSP90AB1
SCHEMBL2977953 0.82 HSP90AB1 (0.76) HSP90AB1
SCHEMBL27088422 0.80 PLA2G2A (0.58) HSP90AB1CNR2CNR1
SCHEMBL8151711 0.80 HSP90AB1 (0.92) HSP90AB1
SCHEMBL478058 0.80 HSP90AB1 (1.00) HSP90AB1
SCHEMBL1592618 0.79 HSP90AB1 (0.61) HSP90AB1
SCHEMBL28588436 0.79 KMT2A (0.55) —
SCHEMBL14558932 0.78 HSP90AB1 (0.53) HSP90AB1CNR2CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 — — US disclosed
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 — — US disclosed
US-20080249137-A1 PPAR active compounds PLEXXIKON INC 2008-10-09 — — US disclosed
EP-1940767-A2 PPARACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2008-07-09 — — EP disclosed
WO-2007030567-A2 PPARACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2007-03-15 — — WO disclosed
WO-2007030567-A2 PPARACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2007-03-15 — — WO 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-20080249137-A1 PPAR active compounds PPARG, PPARA, PPARD HSP90AB1 349/4885CNR2 288/4885CNR1 268/4885

“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.

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