SCHEMBL4200577

SCHEMBL4200577

CCOC(=O)c1ccc(N2CCOCC2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
POLB P06746 1/20 0.57
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
RAB9A P51151 1/20 0.52
MTOR P42345 1/20 0.52
HTT P42858 3/20 0.51
HPGD P15428 2/20 0.51
HSP90AA1 P07900 1/20 0.51
CACNA1B Q00975 1/20 0.51
APBA1 Q02410 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MAPK1 P28482 1/20 0.50
CMA1 P23946 1/20 0.49
F10 P00742 2/20 0.49
GAA P10253 1/20 0.48
LMNA P02545 1/20 0.48
CYP1A2 P05177 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
SCHEMBL17202719 0.85 ALOX5 (0.53) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL1626763 0.85 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL4910068 0.83 PIK3CA (0.47) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL85537 0.82 LIPE (0.52) MEN1KMT2ARAB9AMTORCMA1
SCHEMBL7431121 0.82 HTT (0.57) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL2365836 0.81 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL4690718 0.80 MEN1 (0.71) ALDH1A1SMN1; SMN2POLBMEN1KMT2A
SCHEMBL4196712 0.80 PKM (0.67) ALDH1A1RAB9AHTTHPGDHSP90AA1
SCHEMBL16703298 0.79 CMA1 (0.54) ALDH1A1KMT2AMTORCMA1F10
SCHEMBL7906874 0.79 F10 (0.53) ALDH1A1F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103360380-B A kind of synthetic method of razaxaban and the intermediate of razaxaban and preparation thereof ZHEJIANG TIANYU PHARMACEUTICAL CO., LTD. (CN) 2016-01-20 CN disclosed
CN-103360380-A Synthesis method of rivaroxaban, and rivaroxaban intermediate and preparation thereof ZHEJIANG TIANYU PHARMACEUTICAL CO LTD 2013-10-23 CN disclosed
CN-101875654-A The preparation method of 3-acyl amino cumarone-2-carboxylic acid derivative TANABE SEIYAKU CO 2010-11-03 CN disclosed
US-20090023918-A1 PROCESS FOR PREPARING 3-ACYLAMINOBENZOFURAN-2-CARBOXYLIC ACID DERIVATIVE SEKI MASAHIKO 2009-01-22 US disclosed
US-7439368-B2 Process for producing 3-acylaminobenzofuran-2-carboxylic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2008-10-21 US disclosed
EP-1603572-A4 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2008-06-25 EP disclosed
US-20070135428-A1 LACTAM CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS QIAO JENNIFER X 2007-06-14 US disclosed
US-7205318-B2 Lactam-containing cyclic diamines and derivatives as a factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-04-17 US disclosed
CN-1842528-A Process for preparing 3-acylaminobenzofuran-2-carboxylic acid derivatives TANABE SEIYAKU CO (JP) 2006-10-04 CN disclosed
US-20060173188-A1 Process for producing 3-acylaminobenzofuran-2-carboxylic acid derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2006-08-03 US disclosed
EP-1640373-A1 PROCESS FOR PRODUCING 3-ACYLAMINOBENZOFURAN-2-CARBOXYLIC ACID DERIVATIVE TANABE SEIYAKU CO., LTD. (JP) 2006-03-29 EP disclosed
EP-1603572-A1 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS Bristol-Myers Squibb Company (US) 2005-12-14 EP disclosed
US-20040204454-A1 Lactam-containing cyclic diamines and derivatives as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-10-14 US disclosed
WO-2004082687-A1 LACTAM-CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-09-30 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-20070135428-A1 LACTAM CONTAINING CYCLIC DIAMINES AND DERIVATIVES AS FACTOR XA INHIBITORS F12, F2, PEPD ALDH1A1 3204/4885SMN1; SMN2 2952/4885POLB 2080/4885
US-20040204454-A1 Lactam-containing cyclic diamines and derivatives as factor Xa inhibitors PEPD, TFPI, F2 ALDH1A1 3153/4885SMN1; SMN2 3010/4885POLB 2045/4885
US-20060173188-A1 Process for producing 3-acylaminobenzofuran-2-carboxylic acid derivative F12, F3, F11 ALDH1A1 661/4885SMN1; SMN2 4062/4885POLB 2550/4885
US-20090023918-A1 PROCESS FOR PREPARING 3-ACYLAMINOBENZOFURAN-2-CARBOXYLIC ACID DERIVATIVE F12, F3, F11 ALDH1A1 690/4885SMN1; SMN2 3833/4885POLB 2250/4885

“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.