SCHEMBL7974875

SCHEMBL7974875

CC(C)(C)OC(=O)N1CCc2c[nH]cc2C1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.62
NR1H2 P55055 3/20 0.60
MAPK1 P28482 1/20 0.53
MAPT P10636 5/20 0.47
ADORA1 P30542 1/20 0.44
NAMPT P43490 3/20 0.43
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DDB1 Q16531 2/20 0.42
CRBN Q96SW2 2/20 0.42
KDM4E B2RXH2 2/20 0.41
THRB P10828 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41

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
SCHEMBL21807285 0.89 MAPK1 (0.52) ESR2NR1H2MAPK1MAPTNAMPT
SCHEMBL27148063 0.83 ESR2 (0.61) ESR2NR1H2MAPK1MAPTADORA1
SCHEMBL29369046 0.81 ESR2 (0.70) ESR2NR1H2MAPK1MAPTNAMPT
SCHEMBL1202402 0.81 ESR2 (0.70) ESR2NR1H2MAPK1MAPTNAMPT
Ammonia Solution, Strong SCHEMBL30461763 0.80 ESR2 (0.68) ESR2NR1H2MAPK1MAPTNAMPT
SCHEMBL31359293 0.80 ESR2 (0.72) ESR2NR1H2MAPK1MAPTADORA1
SCHEMBL5599903 0.80 ESR2 (0.72) ESR2NR1H2MAPK1MAPTADORA1
SCHEMBL31054069 0.80 ESR2 (0.68) ESR2NR1H2MAPK1MAPTADORA1
SCHEMBL19005682 0.80 ESR2 (0.53) ESR2NR1H2MAPK1MAPTADORA1
SCHEMBL2132733 0.80 ESR2 (0.53) ESR2NR1H2MAPK1MAPTADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192689-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION 2023-06-22 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
US-20230145336-A1 BRAF DEGRADERS C4 THERAPEUTICS, INC. (US) 2023-05-11 US disclosed
CN-114057739-A Diazepinone derivatives and their use in the treatment of hepatitis b infections 诺维拉治疗公司 2022-02-18 CN disclosed
CN-109641896-B Diazepinone derivatives and their use in the treatment of hepatitis b infections 诺维拉治疗公司 2021-09-21 CN disclosed
US-20170320875-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS INCYTE CORPORATION 2017-11-09 US disclosed
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 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 (3 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-20230192689-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS CD74, IL2, ICOS ESR2 1345/4885NR1H2 278/4885MAPK1 3802/4885
US-20230145336-A1 BRAF DEGRADERS BRAF, NRAS, RAF1 ESR2 2614/4885NR1H2 3374/4885MAPK1 429/4885
US-20170320875-A1 HETEROCYCLIC COMPOUNDS AS IMMUNOMODULATORS CD74, IL2, ICOS ESR2 1345/4885NR1H2 278/4885MAPK1 3802/4885

“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.