SCHEMBL10129482

SCHEMBL10129482

CC(C)C1=C(C#N)C(c2ccc(F)cc2)NC(=O)N1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
GAA P10253 2/20 0.46
MAPT P10636 2/20 0.44
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
IDO1 P14902 1/20 0.38
GSK3B P49841 3/20 0.37
BACE1 P56817 3/20 0.37
CUL4A Q13619 1/20 0.36
RXFP1 Q9HBX9 1/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 1/20 0.34

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
SCHEMBL20096385 0.87 TDP1 (0.47) TDP1GAAMAPTALDH1A1SMN1; SMN2
SCHEMBL13118736 0.80 TDP1 (0.57) TDP1GAAMAPTALDH1A1SMN1; SMN2
SCHEMBL10330877 0.77 TDP1 (0.53) TDP1GAAMAPTALDH1A1SMN1; SMN2
SCHEMBL10153183 0.77 GAA (0.56) TDP1GAAMAPTSMN1; SMN2MEN1
SCHEMBL14248201 0.76 GAA (0.55) TDP1GAAMAPTSMN1; SMN2MEN1
SCHEMBL20096366 0.76 CUL4A (0.36) TDP1GAAMAPTALDH1A1SMN1; SMN2
SCHEMBL10129233 0.74 GAA (0.59) TDP1GAAMAPTALDH1A1MEN1
SCHEMBL28052753 0.74 ALDH1A1 (0.34) TDP1GAAMAPTALDH1A1SMN1; SMN2
SCHEMBL2267031 0.71 GAA (0.50) TDP1GAAMAPTMEN1KMT2A
SCHEMBL10113793 0.71 MAPT (0.65) GAAMAPTALDH1A1SMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118063392-A Improved process for preparing statin precursors 灿盛制药有限公司荷兰公司 2024-05-24 CN disclosed
US-10246423-B2 Process for preparing statin precursor Centrient Pharmaceuticals Netherlands B.V. (NL) 2019-04-02 US disclosed
US-20180111906-A1 IMPROVED PROCESS FOR PREPARING A STATIN PRECURSOR DSM SINOCHEM PHARM NL BV (NL) 2018-04-26 US disclosed
US-20180111906-A1 IMPROVED PROCESS FOR PREPARING A STATIN PRECURSOR DSM SINOCHEM PHARM NL BV (NL) 2018-04-26 US disclosed
US-20180016241-A1 IMPROVED PROCESS FOR PREPARING STATIN PRECURSOR Centrient Pharmaceuticals Netherlands B.V. (NL) 2018-01-18 US disclosed
US-20180016241-A1 IMPROVED PROCESS FOR PREPARING STATIN PRECURSOR Centrient Pharmaceuticals Netherlands B.V. (NL) 2018-01-18 US disclosed
CN-107428702-A Improved process for preparing statin precursors 中化帝斯曼制药有限公司荷兰公司 2017-12-01 CN disclosed
WO-2016151104-A1 IMPROVED PROCESS FOR PREPARING A STATIN PRECURSOR DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2016-09-29 WO disclosed
WO-2016151104-A1 IMPROVED PROCESS FOR PREPARING A STATIN PRECURSOR DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2016-09-29 WO disclosed
WO-2016116589-A1 IMPROVED PROCESS FOR PREPARING STATIN PRECURSOR DSM SINOCHEM PHARMACEUTICALS NETHERLANDS B.V. (NL) 2016-07-28 WO disclosed
EP-2598484-B1 PROCESS FOR THE PREPARATION OF KEY INTERMEDIATES FOR THE SYNTHESIS OF STATINS OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF LEK PHARMACEUTICALS (SI) 2016-06-29 EP 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-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
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-2012172564-A1 PROCESS FOR PREPARATION OF ROSUVASTATIN CALCIUM DR. REDDY'S LABORATORIES LIMITED (IN) 2012-12-20 WO disclosed
EP-2423195-A1 Process for the preparation of key intermediates for the synthesis of statins or pharmaceutically acceptable salts thereof LEK Pharmaceuticals d.d. (SI) 2012-02-29 EP 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 (4 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 TDP1 1584/4885GAA 347/4885MAPT 1208/4885
US-20180016241-A1 IMPROVED PROCESS FOR PREPARING STATIN PRECURSOR HMGCR, STS, DHPS TDP1 1848/4885GAA 2113/4885MAPT 3341/4885
US-20180111906-A1 IMPROVED PROCESS FOR PREPARING A STATIN PRECURSOR HMGCR, CYP11B1, OSBP TDP1 1289/4885GAA 2141/4885MAPT 1599/4885
US-10246423-B2 Process for preparing statin precursor HMGCR, STS, DHPS TDP1 1969/4885GAA 2629/4885MAPT 3249/4885

“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.