SCHEMBL2109995

SCHEMBL2109995

CC(C)(C)OC(=O)N1CCc2cccc(C(=O)O)c21

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.46
ESR2 Q92731 1/20 0.40
UCHL1 P09936 2/20 0.40
MAPK1 P28482 1/20 0.40
NR1H2 P55055 1/20 0.40
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
PRMT5 O14744 2/20 0.38
WDR77 Q9BQA1 2/20 0.38
GPR119 Q8TDV5 1/20 0.38
KDM1A O60341 1/20 0.37
GHSR Q92847 1/20 0.37
DHODH Q02127 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
SCHEMBL10211390 0.89 NOTUM (0.46) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL4666060 0.89 NOTUM (0.43) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL30195056 0.87 HDAC1 (0.42) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL553450 0.87 HDAC1 (0.42) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL619483 0.84 MEN1 (0.48) NOTUMALDH1A1POLBNPC1RAB9A
SCHEMBL3902271 0.83 CNR2 (0.52) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL17545408 0.83 NOTUM (0.45) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL23293654 0.82 NR1H2 (0.46) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL16123405 0.82 UCHL1 (0.51) NOTUMESR2UCHL1MAPK1NR1H2
SCHEMBL31389170 0.82 NR1H2 (0.46) NOTUMESR2UCHL1MAPK1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119145013-A Nickel electroplating liquid and preparation method and application thereof 生益电子股份有限公司 2024-12-17 CN claimed
CN-119145013-A Nickel electroplating liquid and preparation method and application thereof 生益电子股份有限公司 2024-12-17 CN disclosed
EP-3670515-B1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS DANA FARBER CANCER INST INC (US) 2024-03-06 EP disclosed
CN-109328059-B Selective inhibitors of clinically important mutants of EGFR tyrosine kinase CS制药技术有限公司 2021-08-17 CN disclosed
EP-3738964-A1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS Dana Farber Cancer Institute, Inc. (US) 2020-11-18 EP disclosed
US-10787461-B2 Pyrimido-diazepinone compounds and methods of treating disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-09-29 US disclosed
EP-3670515-A1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS Dana Farber Cancer Institute, Inc. (US) 2020-06-24 EP disclosed
US-20200071340-A1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-03-05 US disclosed
US-10457692-B2 Pyrimido-diazepinone compounds and methods of treating disorders DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-10-29 US disclosed
US-20190084998-A1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2019-03-21 US disclosed
US-20090318518-A1 INDOLE AND INDOLINE CYCLOPROPYL AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS MERCK CANADA INC. (CA) 2009-12-24 US disclosed
US-20090318518-A1 INDOLE AND INDOLINE CYCLOPROPYL AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS MERCK CANADA INC. (CA) 2009-12-24 US disclosed
EP-2114877-A1 INDOLE AND INDOLINE CYCLOPROPYL AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS Merck Frosst Canada Ltd. (CA) 2009-11-11 EP disclosed
US-20090105321-A1 Indole Amide Derivatives as Ep4 Receptot Ligands MERCK CANADA INC. (CA) 2009-04-23 US disclosed
US-20090105321-A1 Indole Amide Derivatives as Ep4 Receptot Ligands MERCK CANADA INC. (CA) 2009-04-23 US disclosed
WO-2008104055-A1 INDOLE AND INDOLINE CYCLOPROPYL AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS MERCK FROSST CANADA LTD. (CA) 2008-09-04 WO disclosed
WO-2008104055-A1 INDOLE AND INDOLINE CYCLOPROPYL AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS MERCK FROSST CANADA LTD. (CA) 2008-09-04 WO disclosed
WO-2007143825-A1 INDOLINE AMIDE DERIVATIVES AS EP4 RECEPTOR LIGANDS MERCK FROSST CANADA LTD. (CA) 2007-12-21 WO disclosed
US-20030105118-A1 Tricyclic quinazolinediones SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-06-05 US disclosed
EP-1288216-A1 TRICYCLIC QUINAZOLINEDIONES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2003-03-05 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 (7 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-20200071340-A1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS BRSK2, GRK3, BRSK1 NOTUM 4489/4885ESR2 1641/4885UCHL1 4517/4885
US-20190084998-A1 PYRIMIDO-DIAZEPINONE COMPOUNDS AND METHODS OF TREATING DISORDERS BRSK2, GRK3, BRSK1 NOTUM 4489/4885ESR2 1641/4885UCHL1 4517/4885
US-10787461-B2 Pyrimido-diazepinone compounds and methods of treating disorders BRSK2, GRK3, BRSK1 NOTUM 4489/4885ESR2 1641/4885UCHL1 4517/4885
US-10457692-B2 Pyrimido-diazepinone compounds and methods of treating disorders BRSK2, GRK3, BRSK1 NOTUM 4489/4885ESR2 1641/4885UCHL1 4517/4885
US-20090318518-A1 INDOLE AND INDOLINE CYCLOPROPYL AMIDE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS PTGER4, PTGER1, PTGER3 NOTUM 2678/4885ESR2 198/4885UCHL1 3898/4885
US-20030105118-A1 Tricyclic quinazolinediones PARP1, PARP11, PARP2 NOTUM 4410/4885ESR2 1932/4885UCHL1 2745/4885
US-20090105321-A1 Indole Amide Derivatives as Ep4 Receptot Ligands PTGER4, PTGER1, GPR4 NOTUM 4319/4885ESR2 88/4885UCHL1 4588/4885

“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.