SCHEMBL24401901

SCHEMBL24401901

Oc1ccc2c(c1)Oc1ccccc1[C@@]21OCc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 7/20 0.51
HPGD P15428 2/20 0.51
MAPT P10636 2/20 0.51
MEN1 O00255 1/20 0.51
CYP2C19 P33261 1/20 0.51
HTT P42858 1/20 0.51
RECQL P46063 1/20 0.51
BLM P54132 1/20 0.51
SMAD3 P84022 1/20 0.51
KMT2A Q03164 1/20 0.51
PRMT1 Q99873 1/20 0.51
ACE2 Q9BYF1 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
ALDH1A1 P00352 2/20 0.43
CYP2C9 P11712 1/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
BRCA1 P38398 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TRPA1 O75762 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
SCHEMBL24401890 1.00 FTO (0.51) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL3794922 0.97 FTO (0.54) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL24401887 0.89 FTO (0.47) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL24401902 0.89 FTO (0.47) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL18240028 0.87 FTO (0.45) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL29558140 0.86 MAOA (0.43) RAB9A
SCHEMBL18240031 0.84 FTO (0.43) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL19273266 0.84 FTO (0.43) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL18240025 0.84 FTO (0.43) FTOHPGDMAPTMEN1CYP2C19
SCHEMBL8509074 0.83 FTO (0.41) FTOHPGDMAPTMEN1CYP2C19

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-20220135604-A1 Fluorogenic Probe Using a Mislow-Evans Rearrangement for Real-Time Imaging of Hydrogen Peroxide NATIONAL SCIENCE FOUNDATION 2022-05-05 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-20220135604-A1 Fluorogenic Probe Using a Mislow-Evans Rearrangement for Real-Time Imaging of Hydrogen Peroxide GPX4, SELENOI, SIGMAR1 FTO 2231/4885HPGD 2211/4885MAPT 4658/4885

“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.