SCHEMBL1449217

SCHEMBL1449217

CN(C)C=CC(=O)c1cccc(P(c2ccccc2)c2ccccc2)c1

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.66
MAPT P10636 10/20 0.60
ALDH1A1 P00352 9/20 0.60
HTT P42858 4/20 0.60
GAA P10253 3/20 0.60
HPGD P15428 3/20 0.60
RAB9A P51151 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.54
POLB P06746 3/20 0.51
HSP90AA1 P07900 2/20 0.51
NPC1 O15118 2/20 0.51
LMNA P02545 3/20 0.48
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 2/20 0.46
ALOX12 P18054 1/20 0.46
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL12742903 1.00 RECQL (0.66) RECQLMAPTALDH1A1HTTGAA
SCHEMBL14063274 1.00 RECQL (0.66) RECQLMAPTALDH1A1HTTGAA
SCHEMBL1448946 0.95 MAPT (0.65) RECQLMAPTALDH1A1HTTGAA
SCHEMBL1448532 0.86 RECQL (0.72) RECQLMAPTALDH1A1HTTGAA
SCHEMBL12742913 0.86 RECQL (0.72) RECQLMAPTALDH1A1HTTGAA
SCHEMBL5946453 0.82 MAPT (0.77) RECQLMAPTALDH1A1HTTGAA
SCHEMBL12742925 0.81 MAPT (0.58) RECQLMAPTALDH1A1HTTGAA
SCHEMBL446006 0.81 RECQL (1.00) RECQLMAPTALDH1A1HTTGAA
SCHEMBL29176317 0.81 RECQL (1.00) RECQLMAPTALDH1A1HTTGAA
SCHEMBL425338 0.81 RECQL (1.00) RECQLMAPTALDH1A1HTTGAA

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
US-7910744-B2 Pyrazole and Pyrimidine groups are introduced on aromatic phosphine; (3-bromophenyl)methyl ketone and ethylene glycol cyclize to [3-(2-methyl-1,3-dioxolane-2-yl)phenyl]diphenylphosphane; adding hydrazine monohydrate, then oxidizing with hydrogen peroxide; [3-(3-Pyrazolyl)phenyl]diphenylphosphane oxide ZYLUM BETEILIGUNGSGESELLSCHAFT MBH & CO. PATENT II KG (DE) 2011-03-22 US disclosed
EP-1805193-B1 METHOD FOR THE PRODUCTION OF SUBSTITUTED PHOSPHANES ZYLUM BETEILIGUNGSGMBH & CO PATENTE II KG (DE) 2010-12-29 EP disclosed
US-20080221335-A1 Method for the Manufacture of Substituted Phosphanes, and Substituted Phosphanes Manufactured According to Said Method ZYLUM BETEILIGUNGSGESELLSCHAFT MBH & CO. PATENTE II KG (DE) 2008-09-11 US disclosed
EP-1805193-A1 METHOD FOR THE PRODUCTION OF SUBSTITUTED PHOSPHANES, AND SUBSTITUTED PHOSPHANES PRODUCED ACCORDING TO SAID METHOD Technische Universität Chemnitz (DE) 2007-07-11 EP disclosed
WO-2006045272-A1 METHOD FOR THE PRODUCTION OF SUBSTITUTED PHOSPHANES, AND SUBSTITUTED PHOSPHANES PRODUCED ACCORDING TO SAID METHOD TECHNISCHE UNIVERSITÄT CHEMNITZ (DE) 2006-05-04 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-20080221335-A1 Method for the Manufacture of Substituted Phosphanes, and Substituted Phosphanes Manufactured According to Said Method SCLY, SELENOI, TST RECQL 4795/4885MAPT 4444/4885ALDH1A1 1760/4885

“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.