SCHEMBL5354579

SCHEMBL5354579

OCc1ccc(-c2cn(Cc3ccccc3)c3ccccc23)s1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.49
POLB P06746 1/20 0.48
F2RL3 Q96RI0 1/20 0.47
PDE4A P27815 7/20 0.47
PDE4B Q07343 7/20 0.47
PDE4C Q08493 7/20 0.47
PDE4D Q08499 7/20 0.47
PDE3B Q13370 5/20 0.47
PDE3A Q14432 5/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA9 Q16790 1/20 0.46
LMNA P02545 1/20 0.45
CYP19A1 P11511 1/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
TSHR P16473 1/20 0.45

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
SCHEMBL27661350 0.87 NR1I2 (0.45) SIRT2POLBF2RL3PDE4APDE4B
SCHEMBL5358145 0.79 SIRT2 (0.52) SIRT2F2RL3PDE4APDE4BPDE4C
SCHEMBL4754296 0.77 SIRT2 (0.61) SIRT2POLBF2RL3PDE4APDE4B
SCHEMBL5355132 0.76 F2RL3 (0.62) SIRT2POLBF2RL3PDE4APDE4B
SCHEMBL5357541 0.75 SIRT2 (0.53) SIRT2POLBF2RL3PDE4APDE4B
SCHEMBL2292350 0.74 PDE5A (0.57) SIRT2POLBF2RL3PDE4APDE4B
SCHEMBL7113697 0.74 POLB (0.74) POLBLMNACYP19A1ALDH1A1MEN1
SCHEMBL5356793 0.73 HTR6 (0.61) CA12CA1CA2CA9LMNA
SCHEMBL5563910 0.73 PDE5A (0.59) F2RL3PDE4APDE4BPDE4CPDE4D
SCHEMBL7441184 0.71 F2RL3 (0.55) SIRT2POLBF2RL3PDE4APDE4B

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-7176230-B2 Synthesis of indole analogs of 1-benzyl-3-(5′-hydroxymethyl-2′-furyl) indazole (YC-1) as anti-platelet agents INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2007-02-13 US disclosed
US-20060106041-A1 Synthesis of indole analogs of 1-benzyl-3-(5'-hydroxymethy 1-2' -furyl) indazole (YC-1) as anti-platelet agents INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2006-05-18 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-20060106041-A1 Synthesis of indole analogs of 1-benzyl-3-(5'-hydroxymethy 1-2' -furyl) indazole (YC-1) as anti-platelet agents PFKP, HMOX1, TPH1 SIRT2 2606/4885POLB 3914/4885F2RL3 514/4885

“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.