SCHEMBL4408650

SCHEMBL4408650

COc1cc2c(cc1O)OCC(c1ccc(O)cc1)=C2

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RARA P10276 2/20 0.40
RARG P13631 2/20 0.40
RARB P10826 1/20 0.40
MAOB P27338 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
NR1H4 Q96RI1 2/20 0.39
QDPR P09417 2/20 0.37
CHEK1 O14757 2/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
ESR1 P03372 4/20 0.36
ESR2 Q92731 4/20 0.36

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
SCHEMBL677785 0.84 ESR2 (0.42) RARARARGRARBMAOBNR1H4
SCHEMBL612956 0.81 MAOB (0.49) RARARARGRARBMAOBNR1H4
SCHEMBL5962012 0.80 ALOX12 (0.45) RARARARGRARBNR1H4GAA
SCHEMBL616710 0.77 RARA (0.49) RARARARGRARBMAOBNR1H4
SCHEMBL952469 0.76 NR1H4 (0.54) RARARARGRARBMAOBNR1H4
Idronoxil SCHEMBL29353213 0.76 ESR2 (0.49) RARARARGRARBMAOBNR1H4
Idronoxil SCHEMBL149612 0.76 ESR2 (0.49) RARARARGRARBMAOBNR1H4
SCHEMBL2755025 0.75 KDM4E (0.42) RARARARGRARBMAOBNR1H4
SCHEMBL3232102 0.73 MIF (0.38) RARARARGRARBHDAC6NR1H4
SCHEMBL13704314 0.72 QDPR (0.43) MAOBNR1H4QDPRGAAALOX15

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-20090312408-A1 ISOFLAVAN AND ISOFLAVENE COMPOUNDS AND THEIR USE AS ANGIOGENESIS INHIBITORS ADLERCREUTZ HERMAN 2009-12-17 US claimed
EP-1991538-A1 ISOFLAVAN AND ISOFLAVENE COMPOUNDS AND THEIR USE AS ANGIOGENESIS INHIBITORS Adlercreutz, Herman (FI) 2008-11-19 EP claimed
WO-2007096471-A1 ISOFLAVAN AND ISOFLAVENE COMPOUNDS AND THEIR USE AS ANGIOGENESIS INHIBITORS ADLERCREUTZ HERMAN (FI) 2007-08-30 WO claimed

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-20090312408-A1 ISOFLAVAN AND ISOFLAVENE COMPOUNDS AND THEIR USE AS ANGIOGENESIS INHIBITORS VEGFA, PGF, HIF1AN RARA 3785/4885RARG 2958/4885RARB 3533/4885

“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.