SCHEMBL20109357

SCHEMBL20109357

C=C(C(Cc1ccc(F)cc1)C(=O)OCC)P1(=O)N(c2ccccc2)CCN1c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.43
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39
CCR6 P51684 1/20 0.39
KMT2A Q03164 1/20 0.39
HKDC1 Q2TB90 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
TP53 P04637 1/20 0.38
CACNA1G O43497 1/20 0.37
PPARG P37231 3/20 0.37
EPHX2 P34913 1/20 0.37
NPY1R P25929 1/20 0.37
NPY2R P49146 1/20 0.37
L3MBTL1 Q9Y468 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
SCHEMBL17596815 0.92 MMP8 (0.50) MMP8ALDH1A1TP53NPY1RNPY2R
SCHEMBL20109149 0.92 MMP8 (0.44) MMP8KDM4EALDH1A1MEN1LMNA
SCHEMBL17595853 0.90 MMP8 (0.43) MMP8KDM4EALDH1A1MEN1LMNA
SCHEMBL17595866 0.90 MMP8 (0.46) MMP8ALDH1A1MAPTTP53PPARG
SCHEMBL21866407 0.90 MMP8 (0.43) MMP8KDM4EALDH1A1MEN1LMNA
SCHEMBL17596788 0.89 MMP8 (0.41) MMP8KDM4EALDH1A1TP53PPARG
SCHEMBL20113628 0.89 MMP8 (0.42) MMP8KDM4EALDH1A1MEN1LMNA
SCHEMBL17596771 0.86 MAPT (0.42) MMP8KDM4EALDH1A1MEN1LMNA
SCHEMBL20109272 0.84 GAA (0.40) MMP8KDM4EALDH1A1MEN1LMNA
SCHEMBL20109340 0.84 MMP8 (0.39) MMP8KDM4EALDH1A1MEN1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10633403-B2 N-heterocyclic phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA (US) 2020-04-28 US disclosed
US-10633403-B2 N-heterocyclic phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA (US) 2020-04-28 US disclosed
US-20180118770-A1 N-Heterocyclic Phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2018-05-03 US disclosed
US-20180118770-A1 N-Heterocyclic Phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2018-05-03 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-20180118770-A1 N-Heterocyclic Phosphines NANP, PPIP5K2, PHPT1 MMP8 4444/4885KDM4E 3603/4885ALDH1A1 4621/4885
US-10633403-B2 N-heterocyclic phosphines NANP, PPIP5K2, PHPT1 MMP8 4444/4885KDM4E 3603/4885ALDH1A1 4621/4885

“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.