SCHEMBL5239227

SCHEMBL5239227

C=CCOc1cc(O)c2c(=O)c3cccc(OC)c3oc2c1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAOA P21397 13/20 0.74
TOP2A P11388 4/20 0.61
ACHE P22303 1/20 0.60
MAOB P27338 1/20 0.60
MGAM O43451 1/20 0.53
ATP1A1 P05023 1/20 0.48
ATP1B1 P05026 1/20 0.48
ATP1A3 P13637 1/20 0.48
ATP1B2 P14415 1/20 0.48
ATP1A2 P50993 1/20 0.48
ATP1B3 P54709 1/20 0.48
FXYD2 P54710 1/20 0.48
ATP1A4 Q13733 1/20 0.48
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL6285040 0.90 MAOA (0.72) MAOATOP2AACHEMAOBKDM4E
SCHEMBL7931361 0.85 MAOA (1.00) MAOATOP2AACHEMAOBMGAM
SCHEMBL14466970 0.84 MAOA (0.76) MAOATOP2AACHEMAOBMGAM
SCHEMBL5349187 0.84 MAOA (0.76) MAOATOP2AACHEMAOBMGAM
SCHEMBL5348538 0.82 MAOA (0.83) MAOATOP2AACHEMAOBMGAM
SCHEMBL30346290 0.82 MAOA (0.83) MAOATOP2AACHEMAOBMGAM
SCHEMBL11031411 0.82 TOP2A (0.75) MAOATOP2AACHEMAOBMGAM
SCHEMBL11033772 0.82 MAOA (0.71) MAOATOP2AACHEMAOBMGAM
SCHEMBL11031797 0.81 MAOA (0.70) MAOATOP2AACHEMAOBMGAM
SCHEMBL11031418 0.81 TOP2A (0.74) MAOATOP2AACHEMAOBMGAM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585740-A4 PROCESS TO PREPARE PSOROSPERMIN CYLENE PHARMACEUTICALS INC (US) 2007-06-13 EP disclosed
EP-1585740-A2 PROCESS TO PREPARE PSOROSPERMIN Cylene Pharmaceuticals, Inc. (US) 2005-10-19 EP disclosed
US-6933396-B2 Process to prepare psorospermin CYLENE PHARMACEUTICALS (US) 2005-08-23 US disclosed
US-20040102515-A1 Process to prepare psorospermin CYLENE PHARMACEUTICALS 2004-05-27 US disclosed
WO-2004019888-A2 PROCESS TO PREPARE PSOROSPERMIN CYLENE PHARMACEUTICALS, INC. (US) 2004-03-11 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-20040102515-A1 Process to prepare psorospermin BPGM, DHPS, FDPS MAOA 761/4885TOP2A 1727/4885ACHE 2408/4885

“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.