SCHEMBL21273264

SCHEMBL21273264

COc1ccc2nc(-c3noc(-c4cc5nccn5cn4)n3)ccc2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMO Q99835 2/20 0.42
▸ MAOA P21397 1/20 0.41
▸ MAOB P27338 1/20 0.41
▸ NPC1 O15118 5/20 0.39
▸ RAB9A P51151 5/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ PKM P14618 2/20 0.39
▸ GRM5 P41594 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ NCF1 P14598 1/20 0.37
▸ CYP19A1 P11511 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NQO1 P15559 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ ALOX15 P16050 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
SCHEMBL21273247 0.90 SMO (0.35) SMOMAOAMAOBNPC1RAB9A
SCHEMBL21273258 0.89 SMO (0.36) SMOMAOAMAOBNPC1RAB9A
SCHEMBL21282154 0.89 NPC1 (0.45) SMOMAOAMAOBNPC1RAB9A
SCHEMBL21273250 0.86 MAPT (0.48) MAPT
SCHEMBL21282151 0.79 PKM (0.36) SMOMAOAMAOBNPC1RAB9A
SCHEMBL21282155 0.78 PKM (0.35) SMOMAOAMAOBNPC1RAB9A
SCHEMBL21282191 0.76 SMO (0.42) SMONPC1RAB9ASMN1; SMN2PKM
SCHEMBL21282172 0.75 NPC1 (0.61) NPC1RAB9ASMN1; SMN2PKMGRM5
SCHEMBL21282220 0.75 POLB (0.46) SMONPC1RAB9ASMN1; SMN2PKM
SCHEMBL21273251 0.74 S1PR1 (0.53) NPC1RAB9ASMN1; SMN2PKMGRM5

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 SMO 3104/4885MAOA 1234/4885MAOB 912/4885
US-12012394-B2 Alpha-synuclein ligands SNCA, PARK7, LRRK2 SMO 3104/4885MAOA 1234/4885MAOB 912/4885

“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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