SCHEMBL5337975

SCHEMBL5337975

CC(=O)c1cccc(NC(=O)OC(C)(C)C)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
HPGD P15428 2/20 0.60
HDAC3 O15379 1/20 0.60
HDAC1 Q13547 1/20 0.60
HDAC2 Q92769 1/20 0.60
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
RAB9A P51151 3/20 0.57
LMNA P02545 1/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
TDP1 Q9NUW8 1/20 0.55
CYP17A1 P05093 1/20 0.55
ALDH1A1 P00352 4/20 0.54
KAT6A Q92794 1/20 0.54
NPC1 O15118 2/20 0.53
MAPK1 P28482 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NPSR1 Q6W5P4 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51

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
SCHEMBL29867230 1.00 CYP1A2 (0.61) CYP1A2HPGDHDAC3HDAC1HDAC2
SCHEMBL29435026 0.89 HDAC3 (0.58) CYP1A2HDAC3HDAC1HDAC2HDAC8
SCHEMBL222876 0.89 HDAC3 (0.58) CYP1A2HDAC3HDAC1HDAC2HDAC8
SCHEMBL29029431 0.88 HDAC3 (0.56) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL607975 0.88 HDAC3 (0.57) HDAC3HDAC1HDAC2HDAC8HDAC6
SCHEMBL22018723 0.88 HDAC3 (0.57) CYP1A2HPGDHDAC3HDAC1HDAC2
SCHEMBL15789054 0.88 RAB9A (0.61) CYP1A2HPGDHDAC3HDAC1HDAC2
SCHEMBL7439456 0.88 HDAC3 (0.57) CYP1A2HDAC3HDAC1HDAC2HDAC8
SCHEMBL7439461 0.86 HDAC3 (0.56) CYP1A2HPGDHDAC3HDAC1HDAC2
SCHEMBL9646358 0.86 PDK1 (0.59) CYP1A2HDAC3HDAC1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228482-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER HOTSPOT THERAPEUTICS, INC. 2024-07-11 US disclosed
US-11767296-B2 Heteroaryl compounds as kinase inhibitor FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) 2023-09-26 US disclosed
CN-116715625-A Heteroaryl compounds as protein kinase inhibitors 福建海西新药创制股份有限公司 2023-09-08 CN disclosed
CN-111601790-B Heteroaryl compounds as protein kinase inhibitors 福建海西新药创制股份有限公司 2023-03-31 CN disclosed
US-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION NURIX THERAPEUTICS, INC. 2022-12-08 US disclosed
WO-2021021761-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION NURIX THERAPEUTICS, INC. (US) 2021-02-04 WO disclosed
EP-3749646-A1 HETEROARYL COMPOUNDS AS KINASE INHIBITOR Fujian Haixi Pharmaceuticals Co., Ltd (CN) 2020-12-16 EP disclosed
CN-111601790-A Heteroaryl compounds as protein kinase inhibitors 福建海西新药创制有限公司 2020-08-28 CN disclosed
WO-2019174601-A1 HETEROARYL COMPOUNDS AS KINASE INHIBITOR FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) 2019-09-19 WO disclosed
WO-2019174601-A1 HETEROARYL COMPOUNDS AS KINASE INHIBITOR FUJIAN HAIXI PHARMACEUTICALS CO., LTD (CN) 2019-09-19 WO disclosed
EP-3154982-B1 COMPOUNDS COMPRISING 1,1',2,5'-TETRAHYDROSPIRO[INDOLE-3,2'-PYRROLE]-2,5'-DIONE SYSTEM AS INHIBITORS P53-MDM2 PROTEIN-PROTEIN INTERACTION ADAMED SP ZOO (PL) 2018-05-02 EP disclosed
US-20170129903-A1 COMPOUNDS COMPRISING 1,1a,2,5a-TETRAHYDROSPIRO[INDOLE-3,2a-PYRROLE]-2,5a-DIONE SYSTEM AS INHIBITORS P53-MDM2 PROTEIN-PROTEIN INTERACTION ADAMED SP. Z O.O. (PL) 2017-05-11 US disclosed
WO-2015189799-A1 COMPOUNDS COMPRISING 1,1',2,5'-TETRAHYDROSPIRO[INDOLE-3,2'-PYRROLE]-2,5'-DIONE SYSTEM AS INHIBITORS P53-MDM2 PROTEIN-PROTEIN INTERACTION ADAMED SP. Z O.O. (PL) 2015-12-17 WO disclosed
US-7205291-B2 High mouth absorption; antibiotics against gramnegative, grampositive bacteria espscially Staphlococcus pneumonia, Hemophilus influenza DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-17 US disclosed
US-7205291-B2 High mouth absorption; antibiotics against gramnegative, grampositive bacteria espscially Staphlococcus pneumonia, Hemophilus influenza DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-17 US disclosed
US-7205291-B2 High mouth absorption; antibiotics against gramnegative, grampositive bacteria espscially Staphlococcus pneumonia, Hemophilus influenza DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-17 US disclosed
US-20050020566-A1 Novel carbapenem compounds DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-01-27 US disclosed
EP-1443047-A1 NOVEL CARBAPENEM COMPOUNDS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2004-08-04 EP 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 (5 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-20050020566-A1 Novel carbapenem compounds HPN, PRSS1, BPGM CYP1A2 4121/4885HPGD 669/4885HDAC3 913/4885
US-20240228482-A1 COMPOUNDS, COMPOSITIONS AND METHODS OF TREATING CANCER TP53, CASP3, BAX CYP1A2 1412/4885HPGD 401/4885HDAC3 96/4885
US-20170129903-A1 COMPOUNDS COMPRISING 1,1a,2,5a-TETRAHYDROSPIRO[INDOLE-3,2a-PYRROLE]-2,5a-DIONE SYSTEM AS INHIBITORS P53-MDM2 PROTEIN-PROTEIN INTERACTION MDM2, TP53, TP53BP1 CYP1A2 290/4885HPGD 167/4885HDAC3 2577/4885
US-20220387395-A1 UREA, AMIDE, AND SUBSTITUTED HETEROARYL COMPOUNDS FOR CBL-B INHIBITION CBLB, CBL, CBLC CYP1A2 3595/4885HPGD 4340/4885HDAC3 2543/4885
US-11767296-B2 Heteroaryl compounds as kinase inhibitor RET, ERBB2, ABL1 CYP1A2 1556/4885HPGD 4557/4885HDAC3 909/4885

“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.