SCHEMBL20673022

SCHEMBL20673022

CCCc1cc(=O)[nH]c(-n2nc(C)cc2NC(=O)c2ccccc2OC)n1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADCY1 Q08828 17/20 0.68
▸ ADCY8 P40145 12/20 0.68
▸ HTR2B P41595 2/20 0.66
▸ SLC2A1 P11166 2/20 0.63
▸ MAPT P10636 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL20673066 0.93 ADCY1 (0.79) ADCY1ADCY8HTR2B
SCHEMBL20673148 0.88 ADCY1 (0.62) ADCY1ADCY8HTR2BSLC2A1MAPT
SCHEMBL20673133 0.87 ADCY1 (0.86) ADCY1ADCY8HTR2BSLC2A1
SCHEMBL20673024 0.86 ADCY1 (0.71) ADCY1ADCY8HTR2BSLC2A1
SCHEMBL20673129 0.85 ADCY1 (0.85) ADCY1ADCY8HTR2BSLC2A1
SCHEMBL20673246 0.84 ADCY1 (0.56) ADCY1ADCY8HTR2BSLC2A1MAPT
SCHEMBL20673244 0.84 ADCY1 (0.58) ADCY1ADCY8HTR2BSLC2A1MAPT
SCHEMBL23188255 0.81 ADCY1 (1.00) ADCY1ADCY8HTR2B
SCHEMBL23188313 0.81 ADCY1 (1.00) ADCY1ADCY8HTR2B
SCHEMBL20673073 0.81 SLC2A1 (0.62) ADCY1ADCY8HTR2BSLC2A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11667623-B2 Scaffold of adenylyl cyclase inhibitors for chronic pain and opioid dependence PURDUE RESEARCH FOUNDATION (US) 2023-06-06 — — US disclosed
US-11667623-B2 Scaffold of adenylyl cyclase inhibitors for chronic pain and opioid dependence PURDUE RESEARCH FOUNDATION (US) 2023-06-06 — — US disclosed
US-20200239447-A1 NOVEL SCAFFOLD OF ADENYLYL CYCLASE INHIBITORS FOR CHRONIC PAIN AND OPIOID DEPENDENCE PURDUE RESEARCH FOUNDATION (US) 2020-07-30 — — US disclosed
US-10662176-B2 Scaffold of adenylyl cyclase inhibitors for chronic pain and opioid dependence PURDUE RESEARCH FOUNDATION (US) 2020-05-26 — — US disclosed
US-20190023688-A1 NOVEL SCAFFOLD OF ADENYLYL CYCLASE INHIBITORS FOR CHRONIC PAIN AND OPIOID DEPENDENCE PURDUE RESEARCH FOUNDATION (US) 2019-01-24 — — 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-20200239447-A1 NOVEL SCAFFOLD OF ADENYLYL CYCLASE INHIBITORS FOR CHRONIC PAIN AND OPIOID DEPENDENCE CAP1, ADCY1, ADCYAP1R1 ADCY1 2/4885ADCY8 7/4885HTR2B 2025/4885
US-20190023688-A1 NOVEL SCAFFOLD OF ADENYLYL CYCLASE INHIBITORS FOR CHRONIC PAIN AND OPIOID DEPENDENCE CAP1, ADCY1, ADCYAP1R1 ADCY1 2/4885ADCY8 7/4885HTR2B 2025/4885
US-11667623-B2 Scaffold of adenylyl cyclase inhibitors for chronic pain and opioid dependence CAP1, ADCY1, ADCYAP1R1 ADCY1 2/4885ADCY8 11/4885HTR2B 1794/4885
US-10662176-B2 Scaffold of adenylyl cyclase inhibitors for chronic pain and opioid dependence CAP1, ADCY1, ADCYAP1R1 ADCY1 2/4885ADCY8 11/4885HTR2B 1794/4885

“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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