SCHEMBL3473789

SCHEMBL3473789

CC(C)(C)P(=O)(OC(=O)CCc1ccccc1)C(C)(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 2/20 0.49
KEAP1 Q14145 1/20 0.47
KMT2A Q03164 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 1/20 0.45
HTT P42858 1/20 0.45
FFAR1 O14842 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
CYP2C19 P33261 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TRPV1 Q8NER1 1/20 0.42

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
SCHEMBL27560571 0.83 TSHR (0.50) ALDH1A1KMT2AL3MBTL1KDM4ELMNA
SCHEMBL7817852 0.80 TDP1 (0.61) TDP1ALDH1A1KEAP1KMT2AHTT
SCHEMBL27726024 0.79 TDP1 (0.56) TDP1ALDH1A1KEAP1KMT2AL3MBTL1
SCHEMBL28530603 0.78 TDP1 (0.59) TDP1ALDH1A1KEAP1KMT2AL3MBTL1
SCHEMBL3475314 0.77 TDP1 (0.54) TDP1ALDH1A1KEAP1KMT2AL3MBTL1
SCHEMBL7610731 0.76 TDP1 (0.53) TDP1ALDH1A1KEAP1KMT2AL3MBTL1
SCHEMBL1380801 0.76 TDP1 (0.61) TDP1ALDH1A1KEAP1KMT2AL3MBTL1
SCHEMBL11207011 0.75 TDP1 (0.51) TDP1ALDH1A1KEAP1KMT2AL3MBTL1
SCHEMBL27726053 0.74 TDP1 (0.54) TDP1ALDH1A1KEAP1KMT2AMEN1
SCHEMBL8772358 0.73 TDP1 (0.58) TDP1ALDH1A1KEAP1KMT2AL3MBTL1

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-8318960-B2 Diarylphosphine- and dialkylphosphine-containing compounds, processes of preparing same and uses thereof as tridentate ligands TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2012-11-27 US disclosed
US-20100292084-A1 NOVEL DIARYLPHOSPHINE- AND DIALKYLPHOSPHINE-CONTAINING COMPOUNDS, PROCESSES OF PREPARING SAME AND USES THEREOF AS TRIDENTATE LIGANDS TECHNION RESEARCH & DEVELOPMENT FOUNDATION LTD. (IL) 2010-11-18 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-20100292084-A1 NOVEL DIARYLPHOSPHINE- AND DIALKYLPHOSPHINE-CONTAINING COMPOUNDS, PROCESSES OF PREPARING SAME AND USES THEREOF AS TRIDENTATE LIGANDS MVD, DDT, AGPS TDP1 624/4885ALDH1A1 2141/4885KEAP1 569/4885

“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.