SCHEMBL20109148

SCHEMBL20109148

C=C(C(Cc1cc(C)cc(OC)c1)C(=O)OCC)P1(=O)N(c2ccccc2)CCN1c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.37
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
TACR1 P25103 4/20 0.35
L3MBTL1 Q9Y468 4/20 0.35
TDP1 Q9NUW8 4/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
FFAR4 Q5NUL3 1/20 0.35
KDM4E B2RXH2 2/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33

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
SCHEMBL20109340 0.95 MMP8 (0.39) MMP8ALDH1A1TP53TACR1L3MBTL1
SCHEMBL20109220 0.90 MMP8 (0.36) MMP8ALDH1A1TP53TACR1L3MBTL1
SCHEMBL20109245 0.90 MMP8 (0.36) MMP8ALDH1A1TP53TACR1L3MBTL1
SCHEMBL17596815 0.86 MMP8 (0.50) MMP8ALDH1A1TP53L3MBTL1TDP1
SCHEMBL21866401 0.85 MMP8 (0.39) MMP8ALDH1A1TP53TACR1L3MBTL1
SCHEMBL20109149 0.85 MMP8 (0.44) MMP8ALDH1A1TP53L3MBTL1TDP1
SCHEMBL20113634 0.85 MMP8 (0.38) MMP8ALDH1A1TP53TACR1L3MBTL1
SCHEMBL20113430 0.85 MMP8 (0.38) MMP8ALDH1A1TP53TACR1L3MBTL1
SCHEMBL20109357 0.81 MMP8 (0.43) MMP8ALDH1A1TP53L3MBTL1KDM4E
SCHEMBL17595866 0.81 MMP8 (0.46) MMP8ALDH1A1TP53L3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20180118770-A1 N-Heterocyclic Phosphines NANP, PPIP5K2, PHPT1 MMP8 4444/4885ALDH1A1 4621/4885TP53 1611/4885

“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.