SCHEMBL23002141

SCHEMBL23002141

CC(C)(C)OC(=O)c1cccc2c1C1(OC2=O)c2ccc(O)cc2Oc2cc(O)ccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FTO Q9C0B1 10/20 0.55
MAPT P10636 4/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
HPGD P15428 2/20 0.55
HTT P42858 2/20 0.55
TDP1 Q9NUW8 2/20 0.55
CYP2C19 P33261 1/20 0.55
RECQL P46063 1/20 0.55
BLM P54132 1/20 0.55
SMAD3 P84022 1/20 0.55
PRMT1 Q99873 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
ALDH1A1 P00352 3/20 0.47
ALOX12 P18054 2/20 0.47
ALOX15 P16050 2/20 0.47
HSD17B10 Q99714 2/20 0.47
CYP2C9 P11712 1/20 0.47
BRCA1 P38398 1/20 0.47
LMNA P02545 3/20 0.46

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
SCHEMBL23002150 0.88 FTO (0.62) FTOMAPTMEN1KMT2AHPGD
SCHEMBL23749241 0.86 FTO (0.53) FTOMAPTMEN1KMT2AHPGD
SCHEMBL16174263 0.83 FTO (0.56) FTOMAPTMEN1KMT2AHPGD
SCHEMBL9900247 0.83 FTO (0.64) FTOMAPTMEN1KMT2AHPGD
SCHEMBL23001986 0.83 FTO (0.58) FTOMAPTMEN1KMT2AHPGD
SCHEMBL23002085 0.81 FTO (0.59) FTOMAPTMEN1KMT2AHPGD
SCHEMBL7601752 0.77 FTO (0.70) FTOMAPTMEN1KMT2AHPGD
SCHEMBL23153702 0.76 FTO (0.55) FTOMAPTMEN1KMT2AHPGD
SCHEMBL23083080 0.75 FTO (0.73) FTOMAPTMEN1KMT2AHPGD
SCHEMBL24943857 0.75 FTO (0.62) FTOMAPTMEN1KMT2AHPGD

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-20230038702-A1 BRIGHT TARGETABLE RED CA2+ INDICATORS HOWARD HUGHES MEDICAL INSTITUTE 2023-02-09 US disclosed
US-20210054001-A1 BRIGHT TARGETABLE RED CA2+ INDICATORS HOWARD HUGHES MEDICAL INSTITUTE 2021-02-25 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 (2 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-20230038702-A1 BRIGHT TARGETABLE RED CA2+ INDICATORS ATP2A2, ATP2A3, CACNB2 FTO 4539/4885MAPT 1253/4885MEN1 1949/4885
US-20210054001-A1 BRIGHT TARGETABLE RED CA2+ INDICATORS ATP2A2, ATP2A3, CACNB2 FTO 4539/4885MAPT 1253/4885MEN1 1949/4885

“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.