SCHEMBL10129233

SCHEMBL10129233

COC(=O)C1=C(C(C)C)NC(=O)NC1c1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.59
MAPT P10636 2/20 0.56
PTPN1 P18031 1/20 0.50
TDP1 Q9NUW8 2/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MITF O75030 1/20 0.49
ALOX15 P16050 1/20 0.49
KLF5 Q13887 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
LMNA P02545 1/20 0.48
GLA P06280 1/20 0.48
TSHR P16473 1/20 0.46
CACNA1F O60840 1/20 0.46
CACNA1D Q01668 1/20 0.46
CACNA1S Q13698 1/20 0.46
CACNA1C Q13936 1/20 0.46
PKM P14618 1/20 0.45

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
SCHEMBL10113793 0.86 MAPT (0.65) GAAMAPTALDH1A1RXFP1KMT2A
SCHEMBL5336131 0.86 PTPN1 (0.64) GAAMAPTPTPN1ALDH1A1KDM4E
SCHEMBL10153183 0.85 GAA (0.56) GAAMAPTTDP1RXFP1KMT2A
SCHEMBL14248201 0.84 GAA (0.55) GAAMAPTTDP1RXFP1KMT2A
SCHEMBL6563525 0.80 CACNA1F (0.60) GAAPTPN1ALDH1A1KDM4EKMT2A
SCHEMBL2267031 0.79 GAA (0.50) GAAMAPTTDP1RXFP1KMT2A
SCHEMBL2567142 0.79 ALDH1A1 (0.58) GAAMAPTTDP1ALDH1A1KDM4E
SCHEMBL4503574 0.79 ALDH1A1 (0.58) GAAMAPTTDP1ALDH1A1KDM4E
SCHEMBL13118736 0.78 TDP1 (0.57) GAAMAPTTDP1ALDH1A1KDM4E
SCHEMBL28521809 0.77 PTPN1 (0.45) GAAMAPTPTPN1TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112174898-B Novel method for preparing hydroxypyrimidine by continuously oxidizing dihydropyrimidinone 浙江宏元药业股份有限公司 2021-05-04 CN disclosed
CN-112174898-A Novel method for preparing hydroxypyrimidine by continuously oxidizing dihydropyrimidinone 浙江宏元药业股份有限公司 2021-01-05 CN disclosed
US-9085538-B2 Process for the preparation of key intermediates for the synthesis of statins or pharmaceutically acceptable salts thereof LEK PHARMACEUTICALS D.D. (SI) 2015-07-21 US disclosed
US-20140051854-A1 PROCESS FOR THE PREPARATION OF KEY INTERMEDIATES FOR THE SYNTHESIS OF STATINS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF LEK PHARMACEUTICALS D.D. (SI) 2014-02-20 US disclosed
WO-2012013325-A1 PROCESS FOR THE PREPARATION OF KEY INTERMEDIATES FOR THE SYNTHESIS OF STATINS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF LEK PHARMACEUTICALS D.D. (SI) 2012-02-02 WO 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-20140051854-A1 PROCESS FOR THE PREPARATION OF KEY INTERMEDIATES FOR THE SYNTHESIS OF STATINS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF HMGCR, PCSK9, FAH GAA 347/4885MAPT 1208/4885PTPN1 3516/4885

“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.