SCHEMBL17010293

SCHEMBL17010293

CC(C)(C)OC(=O)N1CCc2c(cccc2-c2ccc(C(F)(F)F)cc2)C1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.60
ABHD6 Q9BV23 4/20 0.58
SCN9A Q15858 8/20 0.53
SCN5A Q14524 1/20 0.47
ESR2 Q92731 1/20 0.46
MAPK1 P28482 1/20 0.46
NR1H2 P55055 1/20 0.46
MAPT P10636 1/20 0.45
NAMPT P43490 1/20 0.45
PARP1 P09874 1/20 0.44
TNKS2 Q9H2K2 1/20 0.44
PARP2 Q9UGN5 1/20 0.44

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
SCHEMBL30519105 1.00 UCHL1 (0.60) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL29739756 0.89 UCHL1 (0.58) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL17021263 0.89 UCHL1 (0.58) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL15271994 0.85 SCN9A (0.52) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL17021259 0.85 SCN9A (0.51) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL29739758 0.85 SCN9A (0.51) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL15272482 0.85 SCN9A (0.52) UCHL1ABHD6SCN9ASCN5AESR2
SCHEMBL31742231 0.84 ABHD6 (0.48) UCHL1ABHD6SCN9ASCN5ANAMPT
SCHEMBL31742172 0.84 ABHD6 (0.48) UCHL1ABHD6SCN9ASCN5ANAMPT
SCHEMBL28107776 0.84 SCN9A (0.59) UCHL1ABHD6SCN9ANAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250376445-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2025-12-11 US disclosed
EP-4654970-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2025-12-03 EP disclosed
US-20250129028-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2025-04-24 US disclosed
WO-2024210578-A1 HETEROBICYCLIC COMPOUND AND PHARMACEUTICAL COMPOSITION COMPRISING SAME 주식회사 바오밥에이바이오 2024-10-10 WO disclosed
WO-2024159079-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2024-08-02 WO disclosed
WO-2023147063-A2 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR Opna Bio SA (CH) 2023-08-03 WO disclosed
US-11401258-B2 Isoquinoline derivatives and use thereof PURDUE PHARMA L.P. (US) 2022-08-02 US disclosed
US-20200407338-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA LP (US) 2020-12-31 US disclosed
US-20200407338-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA LP (US) 2020-12-31 US disclosed
US-10738026-B2 Isoquinoline derivatives and use thereof PURDUE PHARMA L.P. (US) 2020-08-11 US disclosed
US-10738026-B2 Isoquinoline derivatives and use thereof PURDUE PHARMA L.P. (US) 2020-08-11 US disclosed
EP-3105217-B1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA LP (US) 2019-05-29 EP disclosed
EP-3105217-B1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA LP (US) 2019-05-29 EP disclosed
US-20170057942-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA L.P. 2017-03-02 US disclosed
US-20170057942-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA L.P. 2017-03-02 US disclosed
US-20170057942-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA L.P. 2017-03-02 US disclosed
EP-3105217-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF Purdue Pharma LP (US) 2016-12-21 EP disclosed
WO-2015123398-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA L.P. (US) 2015-08-20 WO disclosed
WO-2015123398-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF PURDUE PHARMA L.P. (US) 2015-08-20 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 (6 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-10738026-B2 Isoquinoline derivatives and use thereof KCNQ3, KCNQ5, KCNQ4 UCHL1 3538/4885ABHD6 3395/4885SCN9A 67/4885
US-20250129028-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR YAP1, YES1, LATS1 UCHL1 4050/4885ABHD6 3095/4885SCN9A 1683/4885
US-20170057942-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF KCNQ3, KCNQ5, KCNQ4 UCHL1 3538/4885ABHD6 3395/4885SCN9A 67/4885
US-20250376445-A1 COMPOUNDS AND METHODS FOR YAP/TEAD MODULATION AND INDICATIONS THEREFOR YAP1, YES1, LATS1 UCHL1 3977/4885ABHD6 3509/4885SCN9A 1071/4885
US-20200407338-A1 ISOQUINOLINE DERIVATIVES AND USE THEREOF KCNQ3, KCNQ5, KCNQ4 UCHL1 3538/4885ABHD6 3395/4885SCN9A 67/4885
US-11401258-B2 Isoquinoline derivatives and use thereof KCNQ3, KCNQ5, KCNQ4 UCHL1 3538/4885ABHD6 3395/4885SCN9A 67/4885

“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.