SCHEMBL14410568

SCHEMBL14410568

CC(C)(C)Oc1ccc(NC(=O)Oc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.67
MAPT P10636 4/20 0.67
GAA P10253 3/20 0.64
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
LMNA P02545 1/20 0.64
TP53 P04637 1/20 0.64
SMN1; SMN2 Q16637 2/20 0.62
HTT P42858 1/20 0.62
THRB P10828 2/20 0.61
KDM4E B2RXH2 2/20 0.61
GFER P55789 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
RAD51 Q06609 1/20 0.60
RAB9A P51151 1/20 0.57
FAAH O00519 6/20 0.57
HPGD P15428 2/20 0.55
NPSR1 Q6W5P4 1/20 0.53
CYP1A2 P05177 1/20 0.52

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
SCHEMBL6558040 0.88 ALDH1A1 (0.63) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL6815441 0.86 ALDH1A1 (0.69) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL8063648 0.85 ALDH1A1 (0.82) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL4351772 0.84 EPHX2 (0.63) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL9126998 0.83 ALDH1A1 (0.69) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL13945695 0.82 EPHX2 (0.59) MAPTKMT2ATP53SMN1; SMN2RAB9A
Phenyl 4-Methoxyphenylcarbamate SCHEMBL11183948 0.82 ALDH1A1 (0.90) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL21295428 0.82 SMN1; SMN2 (0.74) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL2092785 0.82 SMN1; SMN2 (0.59) ALDH1A1MAPTGAALMNATP53
SCHEMBL23240070 0.81 ALDH1A1 (0.67) ALDH1A1MAPTGAAMEN1KMT2A

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-20070212302-A1 Preparation and Use of a Stable Formulation of Allosteric Effector Compounds ALLOS THERAPEUTICS, INC. (US) 2007-09-13 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 (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-20070212302-A1 Preparation and Use of a Stable Formulation of Allosteric Effector Compounds PRKAA2, PDE7A, CHRM3 ALDH1A1 3307/4885MAPT 2105/4885GAA 3769/4885

“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.