SCHEMBL21273250

SCHEMBL21273250

FCCOc1ccc2nc(-c3noc(-c4cc5nccn5cn4)n3)ccc2c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.48
▸ APP P05067 10/20 0.37
▸ MIF P14174 2/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ PDE10A Q9Y233 1/20 0.34
▸ F2RL3 Q96RI0 1/20 0.33

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
SCHEMBL21282152 0.90 MAPT (0.47) MAPTAPPMIFS1PR1PDE10A
SCHEMBL21273247 0.86 SMO (0.35) MAPTMIFPDE10AF2RL3
SCHEMBL21273264 0.86 SMO (0.42) MAPT
SCHEMBL21273258 0.83 SMO (0.36) MAPTS1PR1F2RL3
SCHEMBL21282151 0.76 PKM (0.36) MAPTMIFS1PR1F2RL3
SCHEMBL21282154 0.75 NPC1 (0.45) MAPT
SCHEMBL21273263 0.74 MAPT (0.49) MAPTAPPS1PR1PDE10A
SCHEMBL21282155 0.73 PKM (0.35) MAPTS1PR1F2RL3
SCHEMBL15949844 0.66 MAPT (1.00) MAPTAPP
SCHEMBL29409748 0.66 MAPT (1.00) MAPTAPP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12012394-B2 Alpha-synuclein ligands WASHINGTON UNIVERSITY (US) 2024-06-18 — — US disclosed
US-20190256492-A1 ALPHA-SYNUCLEIN LIGANDS WASHINGTON UNIVERSITY (US) 2019-08-22 — — 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 (2 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-20190256492-A1 ALPHA-SYNUCLEIN LIGANDS SNCA, PARK7, LRRK2 MAPT 58/4885APP 161/4885MIF 3729/4885
US-12012394-B2 Alpha-synuclein ligands SNCA, PARK7, LRRK2 MAPT 58/4885APP 161/4885MIF 3729/4885

“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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