SCHEMBL25669486

SCHEMBL25669486

COC(=O)/C(=C/c1ccc(C)cc1)NC(C)=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ALDH1A1 P00352 4/20 0.41
MAPT P10636 4/20 0.41
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL14032325 1.00 MEN1 (0.52) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL8430296 0.93 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL8430294 0.93 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL11720751 0.87 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL11720747 0.87 ALDH1A1 (0.49) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL25669500 0.86 MEN1 (0.58) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL8655219 0.85 ALDH1A1 (0.52) ALDH1A1MAPTKDM4ENPC1THRB
SCHEMBL8657420 0.85 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL13906640 0.85 MEN1 (0.46) MEN1KMT2AALDH1A1MAPTSMN1; SMN2
SCHEMBL27569641 0.85 HDAC3 (0.50) MEN1KMT2AALDH1A1MAPTNPC1

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-20230183180-A1 PROCESS OF MAKING ROXADUSTAT SUZHOU PENGXU PHARMATECH CO., LTD. (CN) 2023-06-15 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-20230183180-A1 PROCESS OF MAKING ROXADUSTAT CYP2B6, UGT1A6, CYP2D6 MEN1 2734/4885KMT2A 1095/4885ALDH1A1 752/4885

“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.