SCHEMBL4426539

SCHEMBL4426539

CCOP(=O)(OCC)C(CCN(OCc1ccccc1)C(C)=O)c1ccc(OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
CNR2 P34972 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
SCHEMBL4423933 0.92 POLB (0.45) ALDH1A1MAPT
SCHEMBL4421084 0.90 POLB (0.40) MEN1KMT2A
SCHEMBL4424406 0.89 MAPT (0.43) MAPT
SCHEMBL4434995 0.84 MAPT (0.44) MAPT
SCHEMBL4434706 0.83 POLB (0.37) ALDH1A1MAPT
SCHEMBL4432420 0.83 ALDH1A1 (0.41) MEN1KMT2AALDH1A1MAPTTSHR
SCHEMBL4426464 0.80 GAA (0.36) ALDH1A1TSHR
SCHEMBL4433277 0.80 CA12 (0.40)
SCHEMBL27412073 0.79 POLB (0.41) MEN1KMT2AMAPT
SCHEMBL4428097 0.76 NPC1 (0.44) MEN1KMT2AALDH1A1TSHRNPC1

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-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

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 MEN1 2263/4885KMT2A 2089/4885L3MBTL1 635/4885

“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.