SCHEMBL25328823

SCHEMBL25328823

CCOc1c(CC)c(CC)c(O)c(CC)c1CC

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.31
LTA4H P09960 1/20 0.31
NQO1 P15559 1/20 0.31

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
SCHEMBL25328557 0.89 CYP1A2 (0.32)
SCHEMBL25331642 0.87 CYP1A2 (0.31)
SCHEMBL5587223 0.86
SCHEMBL5587792 0.86
SCHEMBL25418410 0.84 NQO1 (0.36) TSHRNQO1
SCHEMBL25329867 0.83 CYP1A2 (0.37) TSHRLTA4H
SCHEMBL25329587 0.82 IMPDH2 (0.33)
SCHEMBL25329550 0.81 LTA4H (0.35) LTA4H
SCHEMBL16575412 0.81 NQO1 (0.38) TSHRNQO1
SCHEMBL25328693 0.78 LTA4H (0.41) TSHRLTA4H

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12583813-B2 Polymerization inhibitors BASF SE (DE) 2026-03-24 US disclosed
US-20230242472-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2023-08-03 US disclosed
EP-4161892-A1 POLYMERIZATION INHIBITORS BASF SE (DE) 2023-04-12 EP 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-20230242472-A1 POLYMERIZATION INHIBITORS RCE1, CABLES1, DPYD TSHR 4882/4885LTA4H 1432/4885NQO1 61/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 TSHR 4664/4885LTA4H 323/4885NQO1 944/4885

“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.