SCHEMBL25329798

SCHEMBL25329798

CCc1c(O)c(CC)c(CC)c(OC)c1CC

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.34
ALOX5 P09917 4/20 0.34
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32
IMPDH2 P12268 1/20 0.32
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
CA1 P00915 1/20 0.31
CA6 P23280 1/20 0.31
AKR1B1 P15121 1/20 0.30

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
SCHEMBL25327553 0.88 IMPDH2 (0.36) PTGS2ALOX5IMPDH2AKR1B1
SCHEMBL28116022 0.87 ALOX5 (0.33) PTGS2ALOX5CA2CA4TDP1
SCHEMBL25328660 0.86 ALOX5 (0.34) PTGS2ALOX5IMPDH2AKR1B1
SCHEMBL2956027 0.86 PTGS2 (0.42) PTGS2CA2CA4CA1CA6
SCHEMBL5588494 0.85 TDP1 (0.36) PTGS2ALOX5CA2CA4TDP1
SCHEMBL5587793 0.85 ALOX5 (0.33) PTGS2ALOX5CA2CA4TDP1
SCHEMBL25328865 0.82 ALOX5 (0.37) PTGS2ALOX5CA2CA4TDP1
SCHEMBL25329338 0.81 IMPDH2 (0.44) ALOX5IMPDH2
SCHEMBL1760474 0.80 GABRA1 (0.38)
SCHEMBL25328823 0.77 TSHR (0.31)

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
CN-115697954-A Polymerization inhibitor 巴斯夫欧洲公司 2023-02-03 CN 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 PTGS2 594/4885ALOX5 1518/4885CA2 2500/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 PTGS2 8/4885ALOX5 560/4885CA2 2252/4885

“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.