SCHEMBL22322010

SCHEMBL22322010

CCOP(=O)(Cc1ccccc1)Oc1c(C(C)C)cccc1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ELANE P08246 1/20 0.36
KCNH2 Q12809 1/20 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
SCHEMBL20710790 0.82 ELANE (0.34) NPY5RMAPTMAPK1ELANE
SCHEMBL20710786 0.81 SMN1; SMN2 (0.42) NPY5RPOLBMAPTMAPK1NPSR1
SCHEMBL366215 0.78 NPY5R (0.50) NPY5RPOLBMAPTMAPK1NPSR1
SCHEMBL20710879 0.78 NPSR1 (0.38) NPY5RPOLBMAPTMAPK1NPSR1
SCHEMBL20710784 0.78 NPY5R (0.37) NPY5RNPSR1KCNH2
SCHEMBL22321995 0.77 ELANE (0.47) POLBELANE
SCHEMBL17923878 0.77 KLK8 (0.50) NPY5RNPSR1KCNH2
SCHEMBL914767 0.77 NPY5R (0.49) NPY5RPOLBMAPTMAPK1NPSR1
SCHEMBL916329 0.77 NPY5R (0.49) NPY5RPOLBMAPTMAPK1NPSR1
Hydrogen Peroxide SCHEMBL8609887 0.77 NPY5R (0.49) NPY5RPOLBMAPTMAPK1NPSR1

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-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS (US) 2021-02-23 US disclosed
US-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2020-08-13 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 (2 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-20200255461-A1 METAL-FREE DIRECT ARYLATION OF DIALKYL PHOSPHONATES FOR THE SYNTHESIS OF MIXED ALKYL ARYL PHOSPHONATES SLC35B2, PPIP5K2, PPA1 NPY5R 4183/4885POLB 3567/4885MAPT 3417/4885
US-10927135-B2 Metal-free direct arylation of dialkyl phosphonates for the synthesis of mixed alkyl aryl phosphonates SLC35B2, PPIP5K2, PPA1 NPY5R 4183/4885POLB 3567/4885MAPT 3417/4885

“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.