Theofibrate

Theofibrate

SCHEMBL28085094

Cn1c(=O)c2c(ncn2CCOC(=O)C(C)(C)Oc2ccc(Cl)cc2)n(C)c1=O.O=C(O)c1cccnc1

nearest known ligand 0.79

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.51
▸ ADORA2B P29275 3/20 0.48
▸ RXFP1 Q9HBX9 8/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ MAPK1 P28482 3/20 0.44
▸ GAA P10253 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.41

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
Theofibrate SCHEMBL49272 0.89 ADORA2B (0.60) LMNAADORA2BRXFP1ALDH1A1MAPK1
Theofibrate SCHEMBL3960649 0.89 ADORA2B (0.60) LMNAADORA2BRXFP1ALDH1A1MAPK1
Etofylline Nicotinate SCHEMBL1649975 0.79 ADORA2B (0.64) LMNAADORA2BRXFP1ALDH1A1MAPK1
Etofylline SCHEMBL27405019 0.78 LMNA (0.70) LMNAADORA2BRXFP1ALDH1A1MAPK1
SCHEMBL10963461 0.76 LMNA (0.58) LMNAADORA2BRXFP1ALDH1A1MAPK1
SCHEMBL11460190 0.76 OPRK1 (0.55) LMNAADORA2BRXFP1ALDH1A1MAPK1
SCHEMBL11883059 0.74 LMNA (0.52) LMNAADORA2BRXFP1ALDH1A1MAPK1
Etofibrate SCHEMBL29801484 0.73 L3MBTL1 (0.55) LMNAALDH1A1SMN1; SMN2
Etofibrate SCHEMBL3122 0.73 L3MBTL1 (0.55) LMNAALDH1A1SMN1; SMN2
Etofibrate SCHEMBL8168409 0.73 L3MBTL1 (0.55) LMNAALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110251519-A The purposes of DPP IV inhibitor 勃林格殷格翰国际有限公司 2019-09-20 — — CN disclosed
CN-110227078-A The purposes of DPP IV inhibitor 勃林格殷格翰国际有限公司 2019-09-13 — — CN disclosed
CN-110075098-A Purposes of the Li Gelieting in heart and protection renal antidiabetic treatment 勃林格殷格翰国际有限公司 2019-08-02 — — CN disclosed
CN-109700814-A The treatment of diabetes pair although using oral or non-oral antidiabetic medicine treatment in the still insufficient patient of glycemic control 勃林格殷格翰国际有限公司 2019-05-03 — — CN disclosed
CN-108635355-A The purposes of DPP IV inhibitor 勃林格殷格翰国际有限公司 2018-10-12 — — CN disclosed
CN-108042543-A The treatment of diabetes pair although treated using oral or parenteral antidiabetic medicine in the still insufficient patient of glycemic control 勃林格殷格翰国际有限公司 2018-05-18 — — CN disclosed
CN-107961377-A Combination treatment 勃林格殷格翰国际有限公司 2018-04-27 — — CN disclosed
CN-104013627-B For treating the DPP IV inhibitor of NASH disease 勃林格殷格翰国际有限公司 2018-01-12 — — CN disclosed
CN-107252430-A The purposes of DPP IV inhibitor 勃林格殷格翰国际有限公司 2017-10-17 — — CN disclosed
CN-107115530-A Gene diabetes mellitus type utilizes the treatment of DPP IV inhibitor such as BI 1356 勃林格殷格翰国际有限公司 2017-09-01 — — CN disclosed
CN-107028924-A Pharmaceutical composition comprising BI 1356 and melbine 勃林格殷格翰国际有限公司 2017-08-11 — — CN disclosed
CN-106975074-A Treating diabetes 勃林格殷格翰国际有限公司 2017-07-25 — — CN disclosed
CN-102596191-B pharmaceutical composition comprising BI-1356 and metformin 勃林格殷格翰国际有限公司 2016-12-21 — — CN disclosed
CN-106177958-A Comprise DPP 4 inhibitor (BI 1356) and optionally combine the antidiabetic medicine of other antidiabetic drug 勃林格殷格翰国际有限公司 2016-12-07 — — CN disclosed
CN-106109469-A The anti-diabetic treatment of protection blood vessel and cardioprotection 贝林格尔·英格海姆国际有限公司 2016-11-16 — — CN disclosed
CN-103338760-B Anti-diabetic therapy for protecting blood vessels and protecting the heart 贝林格尔.英格海姆国际有限公司 2016-08-17 — — CN disclosed
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