SCHEMBL1995178

SCHEMBL1995178

CCOC(=O)c1nn(-c2ccc(OC)cc2)c2c1CCN(c1ccc(I)cc1)C2=O

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.62
F2 P00734 4/20 0.62
SLC29A1 Q99808 1/20 0.58
PDE4A P27815 3/20 0.57
PDE4B Q07343 3/20 0.57
PDE4C Q08493 3/20 0.57
PDE4D Q08499 3/20 0.57
CCNA2 P20248 1/20 0.56
CDK2 P24941 1/20 0.56
CCNA1 P78396 1/20 0.56

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
SCHEMBL16948138 0.92 F10 (0.64) F10F2SLC29A1PDE4APDE4B
SCHEMBL2000886 0.91 F10 (0.63) F10F2SLC29A1PDE4APDE4B
SCHEMBL15731769 0.91 F10 (0.67) F10F2SLC29A1PDE4APDE4B
SCHEMBL5307046 0.91 F10 (0.67) F10F2SLC29A1PDE4APDE4B
SCHEMBL18660272 0.90 F10 (0.62) F10F2SLC29A1PDE4APDE4B
SCHEMBL5453891 0.90 F10 (0.55) F10F2SLC29A1PDE4APDE4B
SCHEMBL18040316 0.90 F10 (0.61) F10F2SLC29A1PDE4APDE4B
SCHEMBL18040318 0.90 F10 (0.61) F10F2SLC29A1PDE4APDE4B
SCHEMBL17572367 0.90 F10 (0.61) F10F2SLC29A1PDE4APDE4B
SCHEMBL18058755 0.90 F10 (0.61) F10F2SLC29A1PDE4APDE4B

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 112 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015177801-A1 NOVEL PROCESS FOR THE PREPARATION OF A LACTAM-CONTAINING COMPOUND SYMED LABS LIMITED (IN) 2015-11-26 WO claimed
WO-2014108919-A2 NOVEL INTERMEDIATE AND POLYMORPHS OF 1-(4-METHOXYPHENYL)-7-OXO-6-[4-(2-OXOPIPERIDIN-1-YL)PHENYL]-4,5,6,7-TETRAHYDRO-1H-PYRAZOLO[3,4-c] PYRIDINE-3-CARBOXAMIDE AND PROCESS THEREOF MSN LABORATORIES LIMITED (IN) 2014-07-17 WO claimed
WO-2014075648-A1 A METHOD OF PREPARING APIXABAN ZENTIVA, K.S. (CZ) 2014-05-22 WO claimed
WO-2021147302-A1 INTERMEDIATE OF APIXABAN AND PREPARATION METHOD THEREFOR 浙江九洲药业股份有限公司 2021-07-29 WO disclosed
EP-3212620-B1 PROCESS FOR THE PREPARATION OF APIXABAN AND INTERMEDIATES THEREOF JUBILANT GENERICS LTD FORMERLY JUBILANT LIFE SCIENCES DIVISION (IN) 2020-11-25 EP disclosed
EP-3212620-B1 PROCESS FOR THE PREPARATION OF APIXABAN AND INTERMEDIATES THEREOF JUBILANT GENERICS LTD FORMERLY JUBILANT LIFE SCIENCES DIVISION (IN) 2020-11-25 EP disclosed
EP-3228619-B1 PROCESS FOR THE PREPARATION OF APIXABAN ZAKL FARMACEUTYCZNE POLPHARMA SA (PL) 2020-07-29 EP disclosed
US-20200140436-A1 LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-05-07 US disclosed
EP-3190111-B1 PYRAZOLO[3,4-C]PYRIDINE DERIVATIVES CSPC ZHONGQI PHARMACEUTICAL TECH SHIJIAZHUANG CO LTD (CN) 2020-05-06 EP disclosed
EP-3190111-B1 PYRAZOLO[3,4-C]PYRIDINE DERIVATIVES CSPC ZHONGQI PHARMACEUTICAL TECH SHIJIAZHUANG CO LTD (CN) 2020-05-06 EP disclosed
CN-110894196-A Lactam-containing compounds and derivatives thereof as factor Xa inhibitors 百时美-施贵宝控股爱尔兰无限公司 2020-03-20 CN disclosed
US-20050124602-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-06-09 US disclosed
US-20040220174-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-11-04 US disclosed
EP-1467984-A2 SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO (3,4-C) PYRID-2-ONES Bristol-Myers Squibb Company (US) 2004-10-20 EP disclosed
US-6750225-B2 ANTICOAGULANTS BRISTOL-MYERS SQUIBB PHARMS COMPANY 2004-06-15 US disclosed
US-20030212054-A1 Substituted amino methyl factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-11-13 US disclosed
US-20030191115-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-10-09 US disclosed
US-20030181466-A1 Synthesis of 4,5-dihydro-pyrazolo [3,4-c] pyrid-2-ones BRISTOL-MYERS SQUIBB COMPANY 2003-09-25 US disclosed
WO-2003049681-A2 SYNTHESIS OF 4,5-DIHYDRO-PYRAZOLO [3,4-C] PYRID-2-ONES BRISTOL-MYERS SQUIBB COMPANY (US) 2003-06-19 WO disclosed
US-20020177713-A1 1,4,5,6-tetrahydropyrazolo-[3,4,-c]-pyridin-7-ones useful as factor Xa inhibitors BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-11-28 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 (7 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-20030212054-A1 Substituted amino methyl factor Xa inhibitors F11, F10, F9 F10 2/4885F2 12/4885SLC29A1 841/4885
US-20020177713-A1 1,4,5,6-tetrahydropyrazolo-[3,4,-c]-pyridin-7-ones useful as factor Xa inhibitors SERPINC1, SERPINE1, F11 F10 31/4885F2 8/4885SLC29A1 3538/4885
US-20040220174-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors PEPD, PRSS1, CPB1 F10 43/4885F2 4/4885SLC29A1 3160/4885
US-20030181466-A1 Synthesis of 4,5-dihydro-pyrazolo [3,4-c] pyrid-2-ones TFPI, TFPI2, F2 F10 19/4885F2 3/4885SLC29A1 4423/4885
US-20050124602-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors F12, F2, CPB1 F10 43/4885F2 2/4885SLC29A1 3302/4885
US-20200140436-A1 LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS F12, F2, CPB1 F10 43/4885F2 2/4885SLC29A1 3302/4885
US-20030191115-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors PEPD, HABP2, CPB1 F10 33/4885F2 13/4885SLC29A1 2219/4885

“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.