SCHEMBL5041626

SCHEMBL5041626

CC(C)(C)OC(=O)N1C2CCC1CN(c1ccc(Cl)cn1)C2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.59
RET P07949 4/20 0.50
GPR119 Q8TDV5 3/20 0.48
DRD4 P21917 3/20 0.47
HTR1A P08908 2/20 0.47
HTR2A P28223 2/20 0.47
SLC6A4 P31645 2/20 0.47
HTR7 P34969 2/20 0.47
DRD3 P35462 2/20 0.47
DRD2 P14416 2/20 0.47
HTR2C P28335 1/20 0.47
KCNK3 O14649 2/20 0.46
KCNK9 Q9NPC2 2/20 0.46
HSD11B1 P28845 1/20 0.46
JAK1 P23458 3/20 0.44
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
TRPV4 Q9HBA0 1/20 0.42
ADK P55263 1/20 0.40

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
SCHEMBL21262007 1.00 HDAC1 (0.59) HDAC1RETGPR119DRD4HTR1A
SCHEMBL20468896 0.87 HDAC1 (0.60) HDAC1RETGPR119HSD11B1JAK1
SCHEMBL29600378 0.86 HDAC1 (0.59) HDAC1RETGPR119KCNK3KCNK9
SCHEMBL29356365 0.86 HDAC1 (0.64) HDAC1RETGPR119HSD11B1JAK1
SCHEMBL20354562 0.86 HDAC1 (0.64) HDAC1RETGPR119HSD11B1JAK1
SCHEMBL24428346 0.86 HDAC1 (0.59) HDAC1RETGPR119KCNK3KCNK9
SCHEMBL20456823 0.86 HDAC1 (0.62) HDAC1RETGPR119KCNK3KCNK9
SCHEMBL22909889 0.86 HDAC1 (0.59) HDAC1RETGPR119KCNK3KCNK9
SCHEMBL25310135 0.84 GPR119 (0.59) HDAC1RETGPR119KCNK3KCNK9
SCHEMBL25310645 0.84 HDAC1 (0.57) HDAC1RETGPR119KCNK3KCNK9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023139536-A1 (4-PIPERAZIN-1YL)-4-ALKYL-PHTHALAZIN-1(2H)-ONE COMPOUNDS AS PARP7 INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2023-07-27 WO disclosed
US-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-12-06 US disclosed
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2020-10-22 US disclosed
WO-2019153080-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2019-08-15 WO disclosed
EP-1359152-B1 Diazabicyclic derivatives as nicotinic acetylcholine receptor ligands ABBOTT LAB (US) 2008-05-07 EP disclosed
US-7265115-B2 Diazabicyclic CNS active agents ABBOTT LABORATORIES (US) 2007-09-04 US disclosed
US-20030225268-A1 Diazabicyclic CNS active agents ABBVIE INC. 2003-12-04 US disclosed
EP-1359152-A2 Diazabicyclic derivatives as nicotinic acetylcholine receptor ligands ABBOTT LABORATORIES (US) 2003-11-05 EP disclosed
EP-1147112-B1 DIAZABICYCLIC DERIVATIVES AS NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS ABBOTT LAB (US) 2003-10-29 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-11518764-B2 Substituted heteroaryls as inhibitors of the BCL6 BTB domain protein-protein interaction BCL6, BCL6B, BCL3 HDAC1 281/4885RET 1770/4885GPR119 3895/4885
US-20200331921-A1 INHIBITORS OF THE BCL6 BTB DOMAIN PROTEIN-PROTEIN INTERACTION AND USES THEREOF BCL6, BCL6B, BCL3 HDAC1 199/4885RET 2243/4885GPR119 3611/4885
US-20030225268-A1 Diazabicyclic CNS active agents GABRE, GRIN1, CNTN1 HDAC1 957/4885RET 4112/4885GPR119 343/4885

“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.