SCHEMBL30833274

SCHEMBL30833274

Cc1cc(-c2ccccc2F)cc2c1CCNC2

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 5/20 0.46
▸ HTR7 P34969 3/20 0.41
▸ PRCP P42785 1/20 0.39
▸ CD44 P16070 2/20 0.38
▸ PNMT P11086 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ TNKS O95271 1/20 0.37
▸ TNKS2 Q9H2K2 1/20 0.37
▸ HTR6 P50406 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ DAPK3 O43293 1/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ ROCK1 Q13464 1/20 0.35
▸ CLK4 Q9HAZ1 1/20 0.35

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
SCHEMBL18554747 1.00 CD274 (0.46) CD274HTR7PRCPCD44PNMT
Hydrochloric Acid SCHEMBL18554740 0.99 CD274 (0.45) CD274HTR7PRCPCD44PNMT
SCHEMBL18554654 0.81 CD274 (0.45) CD274PRCPCD44PNMTMAOB
SCHEMBL18554655 0.77 CD274 (0.53) CD274CD44PNMTMAOB
SCHEMBL30833272 0.74 CD274 (0.48) CD274CD44PNMTMAOB
SCHEMBL18554736 0.74 CD274 (0.48) CD274CD44PNMTMAOB
SCHEMBL30833271 0.74 PARP10 (0.56) CD274TNKSTNKS2DAPK3PIM1
SCHEMBL18554689 0.74 PARP10 (0.56) CD274TNKSTNKS2DAPK3PIM1
SCHEMBL25244698 0.74 PNMT (0.41) CD44PNMTMAOBHTR6
SCHEMBL31020006 0.74 PNMT (0.41) CD44PNMTMAOBHTR6

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-11945782-B2 Composition and methods of use of tetrahydroisoquinoline small molecules to bind and modulate PCSK9 protein activity SRX CARDIO, LLC (US) 2024-04-02 — — 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-11945782-B2 Composition and methods of use of tetrahydroisoquinoline small molecules to bind and modulate PCSK9 protein activity LDLR, PCSK9, CETP CD274 983/4885HTR7 1970/4885PRCP 350/4885

“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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