SCHEMBL31744975

SCHEMBL31744975

Nc1nc(Cc2ccco2)nc2ccsc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 14/20 0.47
▸ ADORA2A P29274 13/20 0.47
▸ PDE4A P27815 2/20 0.39
▸ PDE4B Q07343 2/20 0.39
▸ PDE4C Q08493 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ PDE3B Q13370 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ CASP1 P29466 1/20 0.38
▸ CASP7 P55210 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ ADORA3 P0DMS8 2/20 0.35
▸ ADORA2B P29275 1/20 0.35
▸ APAF1 O14727 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ CACNA1B Q00975 1/20 0.35
▸ APBA1 Q02410 1/20 0.35
▸ KMT2A Q03164 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
Formic Acid SCHEMBL31744989 0.93 ADORA2A (0.42) ADORA1ADORA2APDE4APDE4BPDE4C
SCHEMBL31745005 0.78 ADORA1 (0.54) ADORA1ADORA2APDE4APDE4BPDE4C
SCHEMBL31685021 0.75 DCPS (0.46) ADORA2ATSHRCASP1CASP7HSD17B10
SCHEMBL7495122 0.70 PDE4A (0.48) ADORA1ADORA2APDE4APDE4BPDE4C
Trifluoroacetic Acid SCHEMBL31745076 0.69 ADORA1 (0.46) ADORA1ADORA2APDE4APDE4BPDE4C
SCHEMBL10875249 0.69 GAA (0.38) ADORA1ADORA2AADORA3ADORA2BKMT2A
SCHEMBL7490709 0.68 PDE4A (0.59) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL31024298 0.68 PDE4A (0.45) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL3679896 0.67 ADORA2A (0.70) ADORA1ADORA2APDE4APDE4BPDE4C
Hydrochloric Acid SCHEMBL31024297 0.67 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DPDE3B

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-20250382305-A1 COMPOUNDS FOR TREATING SPINOCEREBELLAR ATAXIA TYPE 3 PTC THERAPEUTICS INC (US) 2025-12-18 — — 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-20250382305-A1 COMPOUNDS FOR TREATING SPINOCEREBELLAR ATAXIA TYPE 3 ATXN2, SMN1; SMN2, ATXN10 ADORA1 2438/4885ADORA2A 1286/4885PDE4A 683/4885

“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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