SCHEMBL5818521

SCHEMBL5818521

CC1(C)OB(c2ccc(C3CCCCC3)cc2)OC1(C)C

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.51
LPL P06858 12/20 0.47
LIPG Q9Y5X9 12/20 0.47
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA9 Q16790 2/20 0.41
CA12 O43570 1/20 0.41
CA3 P07451 1/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
CA5A P35218 1/20 0.41
CA7 P43166 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CA5B Q9Y2D0 1/20 0.41
F11 P03951 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.38
NOTUM Q6P988 1/20 0.37
ESR2 Q92731 1/20 0.37

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
SCHEMBL3136657 0.98 HIF1A (0.49) HIF1ALPLLIPGCA1CA2
SCHEMBL3708268 0.95 LPL (0.49) HIF1ALPLLIPGCA1CA2
SCHEMBL16112310 0.91 LPL (0.52) HIF1ALPLLIPGCA1CA2
SCHEMBL14804365 0.91 LPL (0.52) HIF1ALPLLIPGCA1CA2
SCHEMBL31222864 0.85 SLC18A3 (0.54) HIF1ALPLLIPG
SCHEMBL2018524 0.85 LPL (0.46) HIF1ALPLLIPGCA1CA2
SCHEMBL20428742 0.85 ESR2 (0.49) HIF1ALPLLIPGCA1CA2
SCHEMBL14804355 0.84 LPL (0.49) HIF1ALPLLIPGCA1CA2
SCHEMBL1983558 0.84 HIF1A (0.42) HIF1ALPLLIPGCA1CA2
SCHEMBL31222936 0.84 SLC18A3 (0.51) HIF1ALPLLIPG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230391779-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND USE THEREOF BETTA PHARMACEUTICALS CO., LTD. (CN) 2023-12-07 US disclosed
EP-4196480-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND USE THEREOF Betta Pharmaceuticals Co., Ltd (CN) 2023-06-21 EP disclosed
US-11572332-B2 Compound, light-emitting device, light-emitting apparatus, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2023-02-07 US disclosed
US-11572332-B2 Compound, light-emitting device, light-emitting apparatus, electronic device, and lighting device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2023-02-07 US disclosed
CN-112441931-A Compound, light-emitting device, light-emitting apparatus, electronic device, and lighting apparatus 株式会社半导体能源研究所 2021-03-05 CN disclosed
US-20210061753-A1 COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-03-04 US disclosed
US-20210061753-A1 COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-03-04 US disclosed
US-20210043840-A1 LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, ORGANIC COMPOUND, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-02-11 US disclosed
CN-111954939-A Light-emitting element, display device, electronic device, organic compound, and lighting device 株式会社半导体能源研究所 2020-11-17 CN disclosed
EP-2887807-B1 BENZIMIDAZOLE HEXAHYDROFURO[3,2-B]FURAN DERIVATIVES USEFUL AS AMP-ACTIVATED PROTEIN KINASE ACTIVATORS MERCK SHARP & DOHME (US) 2019-09-18 EP disclosed
EP-3022210-B1 NEW AZABENZIMIDAZOLE DERIVATIVES BOEHRINGER INGELHEIM INT (DE) 2018-02-21 EP disclosed
US-20170334918-A1 BMP Inhibitors and Methods of Use Thereof THE BRIGHAM AND WOMEN'S HOSPITAL, INC. 2017-11-23 US disclosed
US-9682983-B2 BMP inhibitors and methods of use thereof THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2017-06-20 US disclosed
US-9453025-B2 Tricyclic compounds and PBK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2016-09-27 US disclosed
US-20160046633-A1 BMP INHIBITORS AND METHODS OF USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2016-02-18 US disclosed
US-20150183799-A1 Tricyclic Compounds and PBK Inhibitors Containing the Same ONCOTHERAPY SCIENCE INC (JP) 2015-07-02 US disclosed
US-8962648-B2 Tricyclic compounds and PBK inhibitors containing the same ONCOTHERAPY SCIENCE, INC. (JP) 2015-02-24 US disclosed
US-20130178459-A1 TRICYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME ONCOTHERAPY SCIENCE, INC. (JP) 2013-07-11 US disclosed
WO-2010107768-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-09-23 WO disclosed
WO-2006120349-A1 NOVEL PHENYL-PYRIDINYL-PIPERAZINE DERIVATIVES, A METHOD FOR THE PRODUCTION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES LES LABORATOIRES SERVIER (FR) 2006-11-16 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-20230391779-A1 BICYCLIC COMPOUNDS, COMPOSITIONS AND USE THEREOF CYP11B2, CYP11B1, CYP27A1 HIF1A 584/4885LPL 3471/4885LIPG 3168/4885
US-20210043840-A1 LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, ORGANIC COMPOUND, AND LIGHTING DEVICE DDT, TRPA1, MAP1LC3A HIF1A 4568/4885LPL 527/4885LIPG 860/4885
US-11572332-B2 Compound, light-emitting device, light-emitting apparatus, electronic device, and lighting device ARL1, CRY1, MCOLN1 HIF1A 2507/4885LPL 1246/4885LIPG 2344/4885
US-20130178459-A1 TRICYCLIC COMPOUNDS AND PBK INHIBITORS CONTAINING THE SAME PBDC1, SBK1, PLK2 HIF1A 4423/4885LPL 4071/4885LIPG 3497/4885
US-20160046633-A1 BMP INHIBITORS AND METHODS OF USE THEREOF BMP1, BMPR2, BMP2 HIF1A 308/4885LPL 156/4885LIPG 91/4885
US-20170334918-A1 BMP Inhibitors and Methods of Use Thereof BMP1, BMPR2, BMP2 HIF1A 308/4885LPL 156/4885LIPG 91/4885
US-20210061753-A1 COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, ELECTRONIC DEVICE, AND LIGHTING DEVICE ARL1, CRY1, MCOLN1 HIF1A 2507/4885LPL 1246/4885LIPG 2344/4885
US-20150183799-A1 Tricyclic Compounds and PBK Inhibitors Containing the Same PBDC1, SBK1, PLK2 HIF1A 4423/4885LPL 4071/4885LIPG 3497/4885

“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.