SCHEMBL429428

SCHEMBL429428

CC(C)(C)OC(=O)n1cc(CBr)cn1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.43
SCD O00767 2/20 0.40
ELANE P08246 1/20 0.36
MGLL Q99685 1/20 0.35
FAAH O00519 1/20 0.34
GPR119 Q8TDV5 4/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
BCHE P06276 1/20 0.32
HTT P42858 1/20 0.32
ATM Q13315 1/20 0.32
NR1H2 P55055 1/20 0.32
AKT1 P31749 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL23703179 0.88 ROCK2 (0.41) ROCK2SCDELANEMGLLFAAH
SCHEMBL1844348 0.86 ROCK2 (0.41) ROCK2SCDELANEMGLLFAAH
SCHEMBL18617132 0.86 ROCK2 (0.41) ROCK2SCDELANEMGLLFAAH
SCHEMBL21121081 0.86 ROCK2 (0.41) ROCK2SCDELANEMGLLFAAH
SCHEMBL13354632 0.84 GABRA1 (0.43) ROCK2SCDELANEMGLLFAAH
SCHEMBL2546394 0.83 ROCK2 (0.40) ROCK2SCDELANEMGLLFAAH
SCHEMBL20029212 0.81 SCD (0.47) ROCK2SCDMGLLBCHE
SCHEMBL429675 0.81 NR1H2 (0.43) ROCK2SCDMGLLGPR119ALDH1A1
SCHEMBL23075458 0.80 CYP17A1 (0.49) ROCK2SCDMGLLGPR119
SCHEMBL17633410 0.79 ROCK2 (0.44) ROCK2SCDELANEFAAHGPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12435092-B2 Substituted imidazo[1,2-A]quinazolines as inhibitors of PARG 858 THERAPEUTICS, INC. (US) 2025-10-07 US disclosed
EP-4526304-A1 INHIBITORS OF PARG 858 Therapeutics, Inc. (US) 2025-03-26 EP disclosed
US-12258355-B2 Probes for imaging huntingtin protein CHDI FOUNDATION, INC. (US) 2025-03-25 US disclosed
US-20240352018-A1 SUBSTITUTED IMIDAZO[1,2-a]QUINAZOLINES AND IMIDAZO[1,2-a]PYRIDO[4,3-e]PYRIMIDINES AS INHIBITORS OF PARG 858 THERAPEUTICS, INC. 2024-10-24 US disclosed
EP-4347032-A1 SUBSTITUTED TETRAHYDROFURAN-2-CARBOXAMIDES AS MODULATORS OF SODIUM CHANNELS Vertex Pharmaceuticals Incorporated (US) 2024-04-10 EP disclosed
CN-117813302-A Substituted tetrahydrofuran-2-carboxamides as sodium channel modulators 沃泰克斯药物股份有限公司 2024-04-02 CN disclosed
US-11939335-B2 Substituted imidazo[1,2-a]quinazolines and imidazo [1,2-a]pyrido[4,3-e]pyrimidines as inhibitors of PARG 858 THERAPEUTICS, INC. (US) 2024-03-26 US disclosed
US-20230374022-A1 INHIBITORS OF PARG 858 THERAPEUTICS, INC. 2023-11-23 US disclosed
US-20230374022-A1 INHIBITORS OF PARG 858 THERAPEUTICS, INC. 2023-11-23 US disclosed
WO-2023224998-A1 INHIBITORS OF PARG 858 THERAPEUTICS, INC. (US) 2023-11-23 WO disclosed
WO-2010030810-A1 CARBACEPHEM BETA-LACTAM ANTIBIOTICS ACHAOGEN, INC. (US) 2010-03-18 WO disclosed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
EP-1490064-B1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORP (US) 2009-11-18 EP disclosed
US-7067540-B2 Substituted pyridinones PHARMACIA CORPORATION (US) 2006-06-27 US disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US disclosed
WO-2005018557-A2 SUBSTITUTED PYRIDINONES PHARMACIA CORPORATION (US) 2005-03-03 WO disclosed
EP-1490064-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE Pharmacia Corporation (US) 2004-12-29 EP disclosed
EP-1445249-A1 NOVEL BENSOPHENONE DERIVATIVES OR SALTS THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 2004-08-11 EP disclosed
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US disclosed
WO-2003068230-A1 SUBSTITUTED PYRIDINONES AS MODULATORS OF P38 MAP KINASE PHARMACIA CORPORATION (US) 2003-08-21 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 (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-20230374022-A1 INHIBITORS OF PARG PARG, PLG, SERPINB1 ROCK2 773/4885SCD 719/4885ELANE 241/4885
US-12435092-B2 Substituted imidazo[1,2-A]quinazolines as inhibitors of PARG PARG, PLG, PTGIS ROCK2 995/4885SCD 4286/4885ELANE 312/4885
US-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 ROCK2 761/4885SCD 4417/4885ELANE 3280/4885
US-20240352018-A1 SUBSTITUTED IMIDAZO[1,2-a]QUINAZOLINES AND IMIDAZO[1,2-a]PYRIDO[4,3-e]PYRIMIDINES AS INHIBITORS OF PARG PARG, PLG, PARN ROCK2 1787/4885SCD 4211/4885ELANE 699/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 ROCK2 983/4885SCD 4384/4885ELANE 2505/4885
US-12258355-B2 Probes for imaging huntingtin protein HTT, HYPK, HSPBP1 ROCK2 3581/4885SCD 4024/4885ELANE 2501/4885
US-11939335-B2 Substituted imidazo[1,2-a]quinazolines and imidazo [1,2-a]pyrido[4,3-e]pyrimidines as inhibitors of PARG PARG, PTGIS, PLG ROCK2 1731/4885SCD 4252/4885ELANE 611/4885

“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.