SCHEMBL23925852

SCHEMBL23925852

CCOC(=O)c1cccc(O)c1CC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.62
CA1 P00915 4/20 0.62
CA2 P00918 4/20 0.62
CA7 P43166 4/20 0.62
CA9 Q16790 4/20 0.62
CA14 Q9ULX7 4/20 0.62
TSHR P16473 1/20 0.61
CDC25B P30305 3/20 0.54
ALDH1A1 P00352 2/20 0.53
HSD17B10 Q99714 1/20 0.53
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
SIRT5 Q9NXA8 1/20 0.48
MAPT P10636 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
CYP1A2 P05177 2/20 0.47
TDP1 Q9NUW8 1/20 0.46
CCR6 P51684 1/20 0.46
CLEC4M Q9H2X3 1/20 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
SCHEMBL27660560 0.87 ALDH1A1 (0.64) CA12CA1CA2CA7CA9
SCHEMBL14958374 0.86 TSHR (0.66) CA12CA1CA2CA7CA9
SCHEMBL2655486 0.84 LMNA (0.61) CA12CA1CA2CA7CA9
SCHEMBL4408583 0.84 CA12 (0.46) CA12CA1CA2CA7CA9
SCHEMBL7428925 0.84 TSHR (0.63) CA12CA1CA2CA7CA9
SCHEMBL4987083 0.83 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL6682038 0.83 CA12 (0.54) CA12CA1CA2CA7CA9
SCHEMBL15312370 0.83 TSHR (0.61) CA12CA1CA2CA7CA9
SCHEMBL28059783 0.83 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL1235309 0.82 CA12 (0.67) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230117370-A1 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2023-04-20 US disclosed
US-20230117370-A1 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2023-04-20 US disclosed
WO-2021211982-A2 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2021-10-21 WO disclosed
WO-2021211982-A2 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS OREGON STATE UNIVERSITY (US) 2021-10-21 WO 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-20230117370-A1 REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS CYP2B6, TYR, CYP2D6 CA12 1684/4885CA1 1543/4885CA2 3009/4885

“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.