SCHEMBL4423933

SCHEMBL4423933

CCOP(=O)(OCC)C(CCN(OCc1ccccc1)C(C)=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.45
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.39
GAA P10253 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL4421084 0.94 POLB (0.40) POLBGAA
SCHEMBL4424406 0.93 MAPT (0.43) POLBMAPTGAA
SCHEMBL4426539 0.92 MEN1 (0.44) MAPTALDH1A1
SCHEMBL4434706 0.89 POLB (0.37) POLBMAPTALDH1A1LMNAGAA
SCHEMBL4434995 0.88 MAPT (0.44) POLBMAPTLMNA
SCHEMBL4426464 0.85 GAA (0.36) POLBALDH1A1LMNAGAAKDM4E
SCHEMBL27412073 0.83 POLB (0.41) POLBMAPT
SCHEMBL4425759 0.81 POLB (0.51) POLBMAPTALDH1A1LMNAMAPK1
SCHEMBL4426625 0.81 ACP3 (0.36)
SCHEMBL4425137 0.81 MAPT (0.49) POLBMAPTALDH1A1LMNAMAPK1

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-7638505-B2 Organophosphoric derivatives useful as anti-parasitic agents UNIVERSITEIT GENT (BE) 2009-12-29 US disclosed
US-20080312190-A1 Such as 3-(N-hydroxyacetamido)-1-(3,4-dichlorophenyl)propylphosphonic acid; Antimalaria agents UNIVERSITEIT GENT (BE) 2008-12-18 US disclosed
WO-2005048715-A2 ORGANOPHOSPHORIC COMPOUNDS AND USE THEREOF BIOAGENCY AG (DE) 2005-06-02 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-20080312190-A1 Such as 3-(N-hydroxyacetamido)-1-(3,4-dichlorophenyl)propylphosphonic acid; Antimalaria agents SUB1, CBR1, NAT1 POLB 1824/4885MAPT 4756/4885ALDH1A1 1560/4885

“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.