SCHEMBL25329804

SCHEMBL25329804

CCc1c(C)c(OC)cc(C)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FASN P49327 1/20 0.42
CYP3A4 P08684 2/20 0.42
ALOX5 P09917 6/20 0.41
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
GFER P55789 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
RXFP1 Q9HBX9 1/20 0.37
PTGS2 P35354 2/20 0.37
PTGS1 P23219 1/20 0.37
EGFR P00533 1/20 0.37
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36

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
SCHEMBL25329721 0.88 ALOX5 (0.41) FASNALOX5PDE3BPDE3APTGS2
SCHEMBL25331374 0.86 ALOX5 (0.40) FASNCYP3A4ALOX5MEN1KMT2A
SCHEMBL25329730 0.82 KDM4E (0.38) CYP3A4ALOX5MEN1KMT2AMAPT
SCHEMBL30356482 0.82 FASN (0.45) FASNCYP3A4ALOX5MEN1KMT2A
SCHEMBL24690678 0.81 PDE3B (0.43) FASNCYP3A4ALOX5MEN1KMT2A
SCHEMBL25328938 0.79 PTGS1 (0.43) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL25329749 0.79 ESR1 (0.37) ALOX5PTGS2PTGS1ESR1ESR2
SCHEMBL25329017 0.79 ALDH1A1 (0.35) MAPTALDH1A1ESR1ESR2IDO1
SCHEMBL9507173 0.79 MEN1 (0.48) FASNALOX5MEN1KMT2AMAPT
SCHEMBL24407972 0.79 CYP3A4 (0.47) FASNCYP3A4ALOX5MEN1KMT2A

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 FASN 1594/4885CYP3A4 2975/4885ALOX5 1518/4885
US-12583813-B2 Polymerization inhibitors PTGS1, PTGER1, POT1 FASN 643/4885CYP3A4 1439/4885ALOX5 560/4885

“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.