SCHEMBL2499574

SCHEMBL2499574

CCOc1cccc(OC(C)(C(=O)O)c2ccc(Cl)cc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 5/20 0.44
▸ PPARG P37231 4/20 0.44
▸ KDM4E B2RXH2 5/20 0.44
▸ MAP4K4 O95819 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ CYP1A2 P05177 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ RXRA P19793 1/20 0.42
▸ RXRB P28702 1/20 0.42
▸ NR4A2 P43354 1/20 0.41

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
SCHEMBL11639887 0.83 PPARA (0.47) PPARAPPARGLMNACYP1A2CYP3A4
SCHEMBL11597279 0.81 PPARD (0.50) PPARAPPARGKDM4EPKMCYP1A2
SCHEMBL11595828 0.81 PPARA (0.53) PPARAPPARGKDM4EMEN1KMT2A
SCHEMBL11596698 0.81 PKM (0.45) PPARAPPARGMAP4K4PKMCYP1A2
SCHEMBL2496641 0.81 PPARA (0.43) PPARAPPARGKDM4ECYP1A2CYP3A4
SCHEMBL11596959 0.80 PPARD (0.46) PPARAPPARGKDM4ELMNAPKM
SCHEMBL11597144 0.78 PPARG (0.48) PPARAPPARGKDM4ELMNAPKM
SCHEMBL11597889 0.78 KDM4E (0.42) PPARAPPARGKDM4EPKMCYP1A2
SCHEMBL2494860 0.77 TP53 (0.41) PPARAPPARGKDM4EMEN1MAPT
SCHEMBL11595598 0.77 PPARA (0.55) PPARAPPARGKDM4ECYP1A2CYP3A4

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-8030347-B2 Cylopenta[b]benzofuran derivatives and the utilization thereof BAYER HEALTHCARE AG (DE) 2011-10-04 — — US disclosed
US-20090018113-A1 Novel Cylopenta[B]Benzofuran Derivatives and the Utilization Thereof BAYER HEALTHCARE AG (DE) 2009-01-15 — — 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-20090018113-A1 Novel Cylopenta[B]Benzofuran Derivatives and the Utilization Thereof FKBP1A, FKBP2, FKBP1B PPARA 1130/4885PPARG 1913/4885KDM4E 2325/4885

“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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