SCHEMBL1919863

SCHEMBL1919863

O=C1C(N2CCOCC2)=CCCN1c1ccc(I)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1C3 P42330 1/20 0.44
▸ ABL1 P00519 1/20 0.43
▸ RAD51 Q06609 2/20 0.38
▸ EP300 Q09472 1/20 0.36
▸ KAT2B Q92831 1/20 0.36
▸ MEN1 O00255 4/20 0.35
▸ KMT2A Q03164 4/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ APAF1 O14727 1/20 0.35
▸ TDP2 O95551 1/20 0.35
▸ NSD2 O96028 1/20 0.35
▸ GALK1 P51570 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ HKDC1 Q2TB90 1/20 0.35
▸ NOD2 Q9HC29 1/20 0.35
▸ ATG4B Q9Y4P1 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ HTT P42858 3/20 0.35

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
SCHEMBL15731795 0.87 PIK3R1 (0.39) RAD51EP300KAT2BMEN1KMT2A
SCHEMBL5441070 0.87 MEN1 (0.36) AKR1C3ABL1MEN1KMT2ANPC1
SCHEMBL17576245 0.86 AKR1C3 (0.44) AKR1C3MEN1KMT2ANPC1RAB9A
SCHEMBL29483984 0.86 RAD51 (0.51) AKR1C3RAD51MEN1KMT2AMAPT
SCHEMBL6330031 0.86 KMT2A (0.49) AKR1C3RAD51MEN1KMT2ANPC1
SCHEMBL20050092 0.86 ALDH1A1 (0.42) EP300KAT2BMEN1KMT2ANPC1
SCHEMBL5447292 0.85 MEN1 (0.38) ABL1MEN1KMT2ANPC1RAB9A
SCHEMBL186752 0.85 LMNA (0.51) AKR1C3RAD51MEN1KMT2ANPC1
SCHEMBL18028120 0.84 ALDH1A1 (0.42) RAD51EP300KAT2BMEN1KMT2A
SCHEMBL20694863 0.84 GSK3B (0.39) RAD51EP300KAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9718779-B2 Intermediate and polymorphs of 1-(4-methoxypheny1)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetra hydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide and process thereof MSN LABORATORIES LIMITED (IN) 2017-08-01 — — US claimed
US-20150353541-A1 Novel intermediate and polymorphs of 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetra hydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide and process thereof THIRUMALAI RAJAN SRINIVASAN (US) 2015-12-10 — — US 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
EP-3875457-A1 METHOD FOR PREPARING APIXABAN Hana Pharm. Co. Ltd. (KR) 2021-09-08 — — EP disclosed
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
US-20200140436-A1 LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2020-05-07 — — US disclosed
WO-2020085616-A1 METHOD FOR PREPARING APIXABAN 하나제약 주식회사 2020-04-30 — — WO 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-10336753-B2 Process for the preparation of apixaban and intermediates thereof UNICHEM LABORATORIES LIMITED (IN) 2019-07-02 — — US disclosed
US-10208036-B2 Process for the preparation of Apixaban and intermediates thereof UNICHEM LABORATORIES LIMITED (IN) 2019-02-19 — — US disclosed
EP-1379245-A1 1, 4, 5, 6-TETRAHYDROPYRAZOLO- 3, 4-C]-PYRID IN-7-ONES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-01-14 — — EP 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
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
WO-2003026652-A1 LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-04-03 — — 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
WO-2002085356-A1 1, 4, 5, 6-TETRAHYDROPYRAZOLO-[3, 4-C]-PYRID IN-7-ONES AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2002-10-31 — — 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 (8 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 AKR1C3 4261/4885ABL1 928/4885RAD51 1853/4885
US-20020177713-A1 1,4,5,6-tetrahydropyrazolo-[3,4,-c]-pyridin-7-ones useful as factor Xa inhibitors SERPINC1, SERPINE1, F11 AKR1C3 549/4885ABL1 2298/4885RAD51 3053/4885
US-10336753-B2 Process for the preparation of apixaban and intermediates thereof HAX1, CYP4X1, HTRA1 AKR1C3 364/4885ABL1 3918/4885RAD51 3392/4885
US-10208036-B2 Process for the preparation of Apixaban and intermediates thereof HAX1, CYP4X1, HTRA1 AKR1C3 364/4885ABL1 3918/4885RAD51 3392/4885
US-20030181466-A1 Synthesis of 4,5-dihydro-pyrazolo [3,4-c] pyrid-2-ones TFPI, TFPI2, F2 AKR1C3 1259/4885ABL1 2487/4885RAD51 3630/4885
US-20150353541-A1 Novel intermediate and polymorphs of 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5,6,7-tetra hydro-1H-pyrazolo[3,4-c]pyridine-3-carboxamide and process thereof CYP3A4, CYP4B1, CYP1A1 AKR1C3 842/4885ABL1 652/4885RAD51 1604/4885
US-20200140436-A1 LACTAM-CONTAINING COMPOUNDS AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS F12, F2, CPB1 AKR1C3 1878/4885ABL1 3397/4885RAD51 1496/4885
US-20030191115-A1 Lactam-containing compounds and derivatives thereof as factor Xa inhibitors PEPD, HABP2, CPB1 AKR1C3 1995/4885ABL1 3097/4885RAD51 948/4885

“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.

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