SCHEMBL23571237

SCHEMBL23571237

CCCCCCC(CCCCC)c1cncnc1C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 1/20 0.33
▸ CYP11B2 P19099 1/20 0.33
▸ CYSLTR2 Q9NS75 1/20 0.32
▸ CYSLTR1 Q9Y271 1/20 0.32
▸ NR1I2 O75469 1/20 0.32

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
SCHEMBL23571253 1.00 CYP11B1 (0.33) CYP11B1CYP11B2CYSLTR2CYSLTR1NR1I2
SCHEMBL21361275 0.85 GPR84 (0.35) CYP11B1CYP11B2
SCHEMBL21859724 0.80 CYP11B1 (0.31) CYP11B1CYP11B2CYSLTR2CYSLTR1NR1I2
SCHEMBL25027678 0.79 CYP11B1 (0.37) CYP11B1CYP11B2
SCHEMBL25452117 0.77 CYSLTR2 (0.39) CYSLTR2CYSLTR1
SCHEMBL25452699 0.75 CYSLTR2 (0.38) CYP11B1CYP11B2CYSLTR2CYSLTR1
SCHEMBL26463849 0.74 CYP11B1 (0.38) CYP11B1CYP11B2
SCHEMBL18635979 0.73 TDP1 (0.38) CYSLTR2CYSLTR1NR1I2
SCHEMBL18855230 0.73 TDP1 (0.38) CYSLTR2CYSLTR1NR1I2
SCHEMBL22307857 0.73 NR1I2 (0.36) NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210188843-A1 QUINOLINE COMPOUNDS AND THEIR PREPARATION AND USE AS ANTIMALARIAL AGENTS THE UNITED STATES OF AMERICA,AS REPRESENTED BY THE SECRETARY,DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2021-06-24 — — 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 (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-20210188843-A1 QUINOLINE COMPOUNDS AND THEIR PREPARATION AND USE AS ANTIMALARIAL AGENTS GLS2, RECQL, PYGL CYP11B1 17/4885CYP11B2 22/4885CYSLTR2 2729/4885

“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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