SCHEMBL25330751

SCHEMBL25330751

CCc1c(O)cc(C)c(OC)c1CC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
KCNB1 Q14721 1/20 0.40
ALDH1A1 P00352 1/20 0.40
IMPDH2 P12268 1/20 0.39
ALOX5 P09917 5/20 0.39
PTGS2 P35354 1/20 0.36
APP P05067 1/20 0.36
TUBB4A P04350 1/20 0.35
TUBB P07437 1/20 0.35
TUBA3C P0DPH7 1/20 0.35
TUBA1B P68363 1/20 0.35
TUBA4A P68366 1/20 0.35
TUBB4B P68371 1/20 0.35
TUBB3 Q13509 1/20 0.35
TUBB2A Q13885 1/20 0.35
TUBB8 Q3ZCM7 1/20 0.35
TUBA3E Q6PEY2 1/20 0.35
TUBA1A Q71U36 1/20 0.35
TUBA1C Q9BQE3 1/20 0.35
TUBB6 Q9BUF5 1/20 0.35

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
SCHEMBL19939809 0.88 TDP1 (0.40) TDP1KCNB1ALDH1A1IMPDH2ALOX5
SCHEMBL25328955 0.86 IMPDH2 (0.41) TDP1KCNB1ALDH1A1IMPDH2ALOX5
SCHEMBL25328225 0.86 CYP3A4 (0.42) TDP1KCNB1ALDH1A1IMPDH2ALOX5
SCHEMBL25329233 0.82 MAPT (0.43) TDP1ALDH1A1TUBB1CYP3A4MAPT
SCHEMBL25331290 0.79 NPC1 (0.32) ALDH1A1AKR1B1HPGDNPC1MAPK1
SCHEMBL25329927 0.79 TP53 (0.32) TDP1ALDH1A1CYP3A4HPGDNPC1
SCHEMBL25329825 0.79 PTGS1 (0.36) TDP1ALDH1A1ALOX5PTGS2MAPT
SCHEMBL8352778 0.78 ALOX5 (0.45) TDP1KCNB1ALDH1A1IMPDH2ALOX5
SCHEMBL19464017 0.78 TDP1 (0.43) TDP1KCNB1ALDH1A1IMPDH2ALOX5
SCHEMBL19939813 0.78 ALOX5 (0.45) TDP1KCNB1ALDH1A1IMPDH2ALOX5

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-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
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 TDP1 1161/4885KCNB1 4513/4885ALDH1A1 1314/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 TDP1 892/4885KCNB1 4110/4885ALDH1A1 32/4885

“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.