SCHEMBL20109198

SCHEMBL20109198

C=C(C(Cc1cc(C)cc(OC)c1)C(=O)OCC)P1(=O)SCCS1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPK1 P28482 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.33
HPGD P15428 1/20 0.33
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
MMP8 P22894 1/20 0.32
LDHA P00338 1/20 0.32
KMT2A Q03164 3/20 0.31
MEN1 O00255 1/20 0.30
PRNP P04156 1/20 0.30
TACR1 P25103 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL20113732 0.94 L3MBTL1 (0.39) L3MBTL1ALDH1A1MAPK1TDP1TSHR
SCHEMBL20109174 0.83 ALDH1A1 (0.34) L3MBTL1ALDH1A1MAPK1TDP1TSHR
SCHEMBL20109200 0.82 MMP8 (0.41) L3MBTL1ALDH1A1MAPK1TDP1HPGD
SCHEMBL20113900 0.79 MMP8 (0.53) L3MBTL1ALDH1A1TDP1LMNATP53
SCHEMBL20113729 0.77 EPHX2 (0.41) ALDH1A1TDP1CYP3A4HPGDLMNA
SCHEMBL20113733 0.77 PPARG (0.41) ALDH1A1MAPK1HPGDLMNATP53
SCHEMBL20109148 0.77 MMP8 (0.37) L3MBTL1ALDH1A1MAPK1TDP1TSHR
SCHEMBL20113397 0.76 ALDH1A1 (0.39) L3MBTL1ALDH1A1MAPK1TDP1TSHR
SCHEMBL20113726 0.75 PPARG (0.44) ALDH1A1MMP8KMT2AMEN1
SCHEMBL20109220 0.74 MMP8 (0.36) L3MBTL1ALDH1A1MAPK1TDP1TSHR

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 L3MBTL1 3799/4885ALDH1A1 4621/4885MAPK1 2698/4885

“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.