SCHEMBL25669461

SCHEMBL25669461

COC(=O)CN1C(=O)c2ccc(C)cc2C1=O

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 1/20 0.56
LPAR3 Q9UBY5 1/20 0.56
PIN1 Q13526 1/20 0.53
PIN4 Q9Y237 1/20 0.53
ALDH1A1 P00352 4/20 0.51
POLB P06746 2/20 0.50
CHRM2 P08172 1/20 0.50
LMNA P02545 1/20 0.49
KDM4E B2RXH2 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL14876141 0.84 POLB (0.49) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL522124 0.83 LMNA (0.48) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL22451330 0.83 TDP1 (0.57) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL523171 0.83 ALDH1A1 (0.56) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL521944 0.83 LMNA (0.48) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL14876303 0.83 CASP1 (0.55) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL523176 0.83 CASP3 (0.55) LPAR1LPAR3PIN1PIN4ALDH1A1
SCHEMBL124512 0.82 LPAR1 (0.73) LPAR1LPAR3ALDH1A1POLBCHRM2
SCHEMBL524126 0.82 ALDH1A1 (0.67) ALDH1A1POLBKDM4EMAPTMEN1
SCHEMBL10584655 0.81 LPAR1 (0.55) LPAR1LPAR3CHRM2SMN1; SMN2

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 LPAR1 2106/4885LPAR3 2201/4885PIN1 2333/4885

“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.