SCHEMBL6874571

SCHEMBL6874571

COc1ccc(N(C)C2CCOCC2)cc1N(S)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 7/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ PDE4A P27815 4/20 0.36
▸ PDE4B Q07343 4/20 0.36
▸ PDE4C Q08493 4/20 0.36
▸ KDM4C Q9H3R0 1/20 0.35
▸ IDH1 O75874 1/20 0.35
▸ EZH2 Q15910 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ MALT1 Q9UDY8 1/20 0.34
▸ HTT P42858 1/20 0.33
▸ SMN1; SMN2 Q16637 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
SCHEMBL6875792 0.84 CSF1R (0.38) PDE4DNPC1RAB9APDE4APDE4B
SCHEMBL5044212 0.80 PDE4B (0.40) PDE4DPDE4APDE4BPDE4C
SCHEMBL6880340 0.76 ALDH1A1 (0.40) PDE4DNPC1RAB9AIDH1MEN1
SCHEMBL6874566 0.74 HTT (0.41) PDE4DPDE4APDE4BPDE4CMEN1
SCHEMBL3042604 0.73 MAPT (0.52) NPC1RAB9AMEN1KMT2AKDM4E
SCHEMBL6875469 0.72 SMN1; SMN2 (0.40) PDE4DNPC1RAB9APDE4APDE4B
SCHEMBL6876218 0.72 KMT2A (0.46) NPC1RAB9AMEN1KMT2AALDH1A1
SCHEMBL5713571 0.71 HCRTR2 (0.36) RAB9AKDM4EALDH1A1HTTSMN1; SMN2
SCHEMBL6114258 0.70 HPGD (0.51) MEN1KMT2AALDH1A1
SCHEMBL6179447 0.70 PDE4B (0.47) PDE4DNPC1RAB9APDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1456188-A1 7-AMINO-BENZOTHIAZOLE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-09-15 — — EP disclosed
US-6713499-B2 ADENOSINE RECEPTOR AGONIST HOFFMAN-LA ROCHE INC. 2004-03-30 — — US disclosed
US-20030153566-A1 7-Amino-benzothiazole derivatives F. HOFFMANN-LA ROCHE AG (CH) 2003-08-14 — — US disclosed
WO-2003053946-A1 7-AMINO-BENZOTHIAZOLE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-07-03 — — WO 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-20030153566-A1 7-Amino-benzothiazole derivatives ADORA1, ADORA2A, ADORA3 PDE4D 871/4885NPC1 1316/4885RAB9A 1913/4885

“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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