SCHEMBL22928829

SCHEMBL22928829

CC(C)(C)OC(=O)NC1CCN(C(=O)C2CC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.54
▸ CTSK P43235 2/20 0.54
▸ RECQL P46063 1/20 0.51
▸ EPHX1 P07099 1/20 0.51
▸ HSD11B1 P28845 6/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ BTK Q06187 1/20 0.50
▸ CA1 P00915 1/20 0.49
▸ CA2 P00918 1/20 0.49
▸ NAMPT P43490 1/20 0.46
▸ CKS1B P61024 1/20 0.46
▸ SKP1 P63208 1/20 0.46
▸ SKP2 Q13309 1/20 0.46
▸ EPHX2 P34913 2/20 0.44
▸ KCNA3 P22001 1/20 0.44
▸ PARP1 P09874 1/20 0.43

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
SCHEMBL29983871 0.94 BTK (0.58) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL15731609 0.91 HSD11B1 (0.58) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL26478103 0.89 HSD11B1 (0.48) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL4716377 0.87 CHRNB2 (0.57) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL4713400 0.87 HPGD (0.51) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL4711278 0.87 CTSK (0.45) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL2296901 0.87 RECQL (0.63) HPGDCTSKRECQLHSD11B1CYP2C9
SCHEMBL1226780 0.87 RECQL (0.63) HPGDCTSKRECQLHSD11B1CYP2C9
SCHEMBL4716378 0.87 CHRNB2 (0.57) HPGDCTSKRECQLEPHX1HSD11B1
SCHEMBL4711280 0.87 CTSK (0.45) HPGDCTSKRECQLEPHX1HSD11B1

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-20240246964-A1 SUBSTITUTED 1-ARYL-1’-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1’-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2024-07-25 — — US disclosed
EP-4313968-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2024-02-07 — — EP disclosed
WO-2022208269-A2 SUBSTITUTED 1-ARYL-1'-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1'-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME ARBUTUS BIOPHARMA CORPORATION (CA) 2022-10-06 — — WO disclosed
US-11365195-B2 Atypical inhibitors of monoamine transporters; method of making; and use thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-06-21 — — US disclosed
US-11365195-B2 Atypical inhibitors of monoamine transporters; method of making; and use thereof THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2022-06-21 — — US disclosed
WO-2022109492-A1 PYRROLOPYRIDAZINE COMPOUNDS AS KINASE INHIBITORS GOSSAMER BIOSERVICES, INC. (US) 2022-05-27 — — WO disclosed
US-20210369710-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN NALO THERAPEUTICS (US) 2021-12-02 — — US disclosed
US-20210024523-A1 ATYPICAL INHIBITORS OF MONOAMINE TRANSPORTERS; METHOD OF MAKING; AND USE THEREOF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2021-01-28 — — US 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 (4 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-20210024523-A1 ATYPICAL INHIBITORS OF MONOAMINE TRANSPORTERS; METHOD OF MAKING; AND USE THEREOF SLC18A2, SLC6A3, SLC6A4 HPGD 3556/4885CTSK 2654/4885RECQL 2888/4885
US-11365195-B2 Atypical inhibitors of monoamine transporters; method of making; and use thereof SLC18A2, SLC6A3, SLC6A4 HPGD 3556/4885CTSK 2654/4885RECQL 2888/4885
US-20210369710-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN MYC, MYCBP, MYCBP2 HPGD 3097/4885CTSK 3577/4885RECQL 2767/4885
US-20240246964-A1 SUBSTITUTED 1-ARYL-1’-HETEROARYL COMPOUNDS, SUBSTITUTED 1,1’-BIHETEROARYL COMPOUNDS, AND METHODS USING SAME HAVCR2, HDGF, HCCS HPGD 836/4885CTSK 2660/4885RECQL 232/4885

“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.

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