SCHEMBL30833272

SCHEMBL30833272

Cc1cc2c(cc1-c1ccccc1F)CNCC2

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CD274 Q9NZQ7 5/20 0.48
▸ PNMT P11086 4/20 0.43
▸ CD44 P16070 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ ADRA2A P08913 1/20 0.38
▸ ADRA2B P18089 1/20 0.38
▸ ADRA2C P18825 1/20 0.38
▸ ASIC3 Q9UHC3 1/20 0.38
▸ HTR2C P28335 1/20 0.38
▸ HTR2B P41595 1/20 0.38

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
SCHEMBL18554736 1.00 CD274 (0.48) CD274PNMTCD44MAOBADRA2A
Hydrochloric Acid SCHEMBL18554685 0.99 CD274 (0.47) CD274PNMTCD44MAOBADRA2A
SCHEMBL18555017 0.82 PNMT (0.39) CD274PNMTADRA2AADRA2BADRA2C
SCHEMBL24842428 0.81 CD274 (0.49) CD274PNMTCD44MAOBADRA2A
SCHEMBL18554652 0.80 CYP3A4 (0.52) CD274PNMTCD44MAOBADRA2A
SCHEMBL19914887 0.78 HTR2C (0.53) ADRA2AADRA2BADRA2CHTR2CHTR2B
SCHEMBL14116965 0.77 PNMT (0.47) CD274PNMTCD44MAOBADRA2A
SCHEMBL20909790 0.77 PNMT (0.47) CD274PNMTCD44MAOBADRA2A
SCHEMBL26232606 0.77 CD274 (0.46) CD274PNMTCD44MAOBASIC3
SCHEMBL18554655 0.76 CD274 (0.53) CD274PNMTCD44MAOBADRA2A

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 983/4885PNMT 4172/4885CD44 4521/4885

“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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