SCHEMBL17264239

SCHEMBL17264239

COC(=O)c1c(O)ccc(-c2ccccc2)c1C(=O)OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
CA14 Q9ULX7 1/20 0.58
KDM4E B2RXH2 2/20 0.58
HSD17B10 Q99714 1/20 0.58
EGFR P00533 1/20 0.56
HTT P42858 1/20 0.54
MEN1 O00255 4/20 0.53
KMT2A Q03164 4/20 0.53
LMNA P02545 3/20 0.53
ALDH1A1 P00352 3/20 0.53
HPGD P15428 1/20 0.53
PRKCZ Q05513 1/20 0.53
GABRA1 P14867 1/20 0.51
GABRG2 P18507 1/20 0.51
GABRB3 P28472 1/20 0.51
GABRA5 P31644 1/20 0.51

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
SCHEMBL13228930 0.91 HTT (0.62) CA12CA1CA2CA7CA9
SCHEMBL9049651 0.86 CA12 (0.69) CA12CA1CA2CA7CA9
SCHEMBL7121111 0.85 EGFR (0.52) CA12CA1CA2CA7CA9
SCHEMBL11152302 0.83 HTT (0.54) KDM4EEGFRHTTMEN1KMT2A
SCHEMBL7116141 0.82 EGFR (0.49) CA12CA1CA2CA7CA9
SCHEMBL160098 0.81 CA12 (0.77) CA12CA1CA2CA7CA9
SCHEMBL25550061 0.81 HTT (0.59) CA12CA1CA2CA7CA9
SCHEMBL29416802 0.79 HTT (0.54) CA12CA1CA2CA7CA9
SCHEMBL28769108 0.79 HTT (0.50) KDM4EHSD17B10EGFRHTTMEN1
SCHEMBL6505800 0.79 CA12 (0.62) CA12CA1CA2CA7CA9

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-20150328245-A1 Agents for Eliminating Tumour-Initiating Cells GODAVARI BIOREFINERIES LIMITED (IN) 2015-11-19 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-20150328245-A1 Agents for Eliminating Tumour-Initiating Cells MCL1, CD47, CD44 CA12 58/4885CA1 237/4885CA2 1830/4885

“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.