SCHEMBL1497620

SCHEMBL1497620

COc1ccc2c(c1)cc(B(O)O)n2C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 6/20 0.46
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HSD17B10 Q99714 1/20 0.43
AKR1C3 P42330 3/20 0.43
AKR1C2 P52895 3/20 0.43
TUBB1 Q9H4B7 1/20 0.42
ATR Q13535 1/20 0.39
ATRIP Q8WXE1 1/20 0.39
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
STS P08842 1/20 0.36
PTGS2 P35354 3/20 0.36
PTGS1 P23219 2/20 0.36
CDC42 P60953 1/20 0.36
RAC1 P63000 1/20 0.36
CYP1A2 P05177 1/20 0.36

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
SCHEMBL29955030 1.00 NR1H2 (0.46) NR1H2ALDH1A1KDM4EL3MBTL1HPGD
SCHEMBL29953334 0.90 NR1H2 (0.45) NR1H2ALDH1A1KDM4ECA12CA9
SCHEMBL513258 0.90 NR1H2 (0.45) NR1H2ALDH1A1KDM4ECA12CA9
SCHEMBL2562727 0.86 KCNQ3 (0.41) NR1H2KDM4ECA12CA9
SCHEMBL29764626 0.84 CA12 (0.40) NR1H2ATRATRIPCA12CA9
SCHEMBL1623033 0.84 CA12 (0.40) NR1H2ATRATRIPCA12CA9
SCHEMBL29957250 0.84 NR1H2 (0.44) NR1H2ATRATRIPCA12CA9
SCHEMBL17690271 0.84 ESR2 (0.40) NR1H2CA12CA9
SCHEMBL593975 0.84 NR1H2 (0.44) NR1H2ATRATRIPCA12CA9
SCHEMBL15332131 0.83 NR1H2 (0.37) NR1H2ATRATRIPCA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12636385-B2 Selective ligands for tau aggregates SENTONIX, INC. (US) 2026-05-26 US disclosed
WO-2024263753-A1 SULFOXIMINE BASED STT3A/B MODULATORS FOR THE TREATMENT OF DISEASE Vir Biotechnology, Inc. (US) 2024-12-26 WO disclosed
US-12097262-B2 mTORC1 inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-09-24 US disclosed
US-20240066134-A1 mTORC1 INHIBITORS UNIV CALIFORNIA (US) 2024-02-29 US disclosed
US-20240066134-A1 mTORC1 INHIBITORS UNIV CALIFORNIA (US) 2024-02-29 US disclosed
US-20240066134-A1 mTORC1 INHIBITORS UNIV CALIFORNIA (US) 2024-02-29 US disclosed
WO-2023121238-A1 SUBSTITUTED HETEROCYCLIC DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME (주)메디픽 2023-06-29 WO disclosed
WO-2023121238-A1 SUBSTITUTED HETEROCYCLIC DERIVATIVE COMPOUND AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING CANCER COMPRISING SAME (주)메디픽 2023-06-29 WO disclosed
US-11452780-B2 Mtorc1 inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-09-27 US disclosed
CN-113620978-A mTORC1 inhibitors 加利福尼亚大学董事会 2021-11-09 CN disclosed
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2005-12-01 US disclosed
WO-2005080346-A1 SUBSTITUTED AZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE TRANSTECH PHARMA, INC. (US) 2005-09-01 WO disclosed
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use TRANSTECH PHARMA, INC. 2005-08-25 US disclosed
US-6897207-B2 Azaindoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US disclosed
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-03-17 US disclosed
US-6858638-B2 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2005-02-22 US disclosed
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use AVENTIS PHARMA S.A. (FR) 2004-06-03 US disclosed
US-20040053931-A1 Azaindoles AVENTIS PHARMACEUTICALS INC. 2004-03-18 US disclosed
EP-1397360-A1 AZAINDOLES Aventis Pharma Limited (GB) 2004-03-17 EP disclosed
WO-2003000688-A1 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2003-01-03 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 (9 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-12097262-B2 mTORC1 inhibitors MTOR, RPTOR, RICTOR NR1H2 3712/4885ALDH1A1 4715/4885KDM4E 1643/4885
US-20040106667-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 NR1H2 3796/4885ALDH1A1 2583/4885KDM4E 980/4885
US-20240066134-A1 mTORC1 INHIBITORS MTOR, RPTOR, RICTOR NR1H2 3712/4885ALDH1A1 4715/4885KDM4E 1643/4885
US-20040053931-A1 Azaindoles CDKN1A, CDK7, CDK2 NR1H2 4098/4885ALDH1A1 939/4885KDM4E 709/4885
US-12636385-B2 Selective ligands for tau aggregates MAPT, PSEN2, PSEN1 NR1H2 678/4885ALDH1A1 4853/4885KDM4E 4519/4885
US-20050187277-A1 Substituted azole derivatives, compositions, and methods of use PTPRO, PTPN5, PTPRE NR1H2 2585/4885ALDH1A1 747/4885KDM4E 733/4885
US-20050059722-A1 Substituted indazoles, compositions containing them, method of production and use ABL1, CDK3, CILK1 NR1H2 3732/4885ALDH1A1 2459/4885KDM4E 1149/4885
US-11452780-B2 Mtorc1 inhibitors MTOR, RPTOR, RICTOR NR1H2 3712/4885ALDH1A1 4715/4885KDM4E 1643/4885
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders MAP3K20, MAP3K12, MAP3K19 NR1H2 1652/4885ALDH1A1 3053/4885KDM4E 1826/4885

“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.