SCHEMBL25600201

SCHEMBL25600201

CCOC(=O)[C@@H]1CCCCC1C

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
ALDH1A1 P00352 2/20 0.44
TP53 P04637 1/20 0.43
CYP3A4 P08684 1/20 0.43
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PPM1B O75688 1/20 0.40
PTPN1 P18031 1/20 0.40
PPP1CC P36873 1/20 0.40
MAPT P10636 2/20 0.39
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
FKBP1A P62942 2/20 0.38
THRB P10828 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL13869054 1.00 EPHX1 (0.50) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL13007344 1.00 EPHX1 (0.50) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL2291994 1.00 EPHX1 (0.50) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL13104104 1.00 EPHX1 (0.50) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL12894434 1.00 EPHX1 (0.50) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL12165160 0.98 EPHX1 (0.48) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL12165162 0.98 EPHX1 (0.48) EPHX1ALDH1A1TP53CYP3A4MEN1
SCHEMBL12165163 0.96 EPHX1 (0.45) EPHX1ALDH1A1TP53CYP3A4PPM1B
SCHEMBL13104111 0.96 EPHX1 (0.45) EPHX1ALDH1A1TP53CYP3A4PPM1B
SCHEMBL12671644 0.96 EPHX1 (0.45) EPHX1ALDH1A1TP53CYP3A4PPM1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230150989-A1 HERBICIDAL MALONAMIDES BASF SE (DE) 2023-05-18 US 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-20230150989-A1 HERBICIDAL MALONAMIDES DDT, DHRS9, CA9 EPHX1 234/4885ALDH1A1 475/4885TP53 4576/4885

“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.