SCHEMBL26907192

SCHEMBL26907192

COc1cc(Cc2n[nH]c(=O)c3ccccc23)ccn1

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.66
CYP3A4 P08684 1/20 0.66
CYP2C9 P11712 1/20 0.66
CYP2C19 P33261 1/20 0.66
PARP1 P09874 11/20 0.58
AR P10275 4/20 0.58
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL4573126 0.83 PARP1 (0.62) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL6610436 0.83 PARP1 (0.62) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL12798188 0.78 PARP1 (0.70) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL581787 0.78 AR (0.70) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL26907276 0.78 PARP1 (0.58) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL8270690 0.78 PARP1 (0.58) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL76707 0.78 PARP1 (0.62) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL905630 0.77 AR (0.79) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL3386656 0.77 CYP3A4 (0.80) TSHRCYP3A4CYP2C9CYP2C19PARP1
SCHEMBL12955520 0.77 CYP3A4 (0.80) TSHRCYP3A4CYP2C9CYP2C19PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240174651-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2024-05-30 US disclosed
CN-117355303-A Compounds and their use for the treatment of neurodegenerative, degenerative and metabolic disorders 佛罗里达大学研究基金会公司 2024-01-05 CN disclosed
EP-4284372-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS University of Florida Research Foundation, Incorporated (US) 2023-12-06 EP disclosed
WO-2022165173-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS THE SCRIPPS RESEARCH INSTITUTE (US) 2022-08-04 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 (1 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-20240174651-A1 COMPOUNDS AND USE THEREOF FOR TREATMENT OF NEURODEGENERATIVE, DEGENERATIVE AND METABOLIC DISORDERS NLN, OAT, PC TSHR 3461/4885CYP3A4 1659/4885CYP2C9 2317/4885

“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.