SCHEMBL6596347

SCHEMBL6596347

[O]C/C=C1/SC(=S)NC1=O

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NAT1 P18440 5/20 0.49
▸ CA2 P00918 1/20 0.49
▸ EPHX1 P07099 1/20 0.49
▸ MYC P01106 3/20 0.47
▸ MAX P61244 3/20 0.47
▸ DNM1 Q05193 1/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ CISD1 Q9NZ45 3/20 0.46
▸ MAOA P21397 1/20 0.46
▸ PIM1 P11309 2/20 0.45
▸ PTP4A3 O75365 1/20 0.45
▸ IDH1 O75874 1/20 0.44

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
SCHEMBL6596353 1.00 NAT1 (0.49) NAT1CA2EPHX1MYCMAX
SCHEMBL18163760 0.82 MYC (0.53) NAT1CA2EPHX1MYCMAX
SCHEMBL6594912 0.78 PIM1 (0.47) NAT1NPC1RAB9ACISD1MAOA
SCHEMBL4267481 0.76 MYC (0.48) NAT1CA2EPHX1MYCMAX
SCHEMBL8358185 0.74 — —
SCHEMBL2082404 0.74 — —
SCHEMBL18102998 0.73 NAT1 (0.59) NAT1CA2EPHX1CISD1PIM1
SCHEMBL8171894 0.73 NAT1 (0.59) NAT1CA2EPHX1CISD1PIM1
SCHEMBL8166533 0.71 NPC1 (0.54) NAT1CA2EPHX1MYCMAX
SCHEMBL11116453 0.69 PDE4B (0.49) NAT1CA2EPHX1MYCMAX

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-1063235-B1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LTD (JP) 2004-05-12 — — EP disclosed
US-20030186976-A1 Benzofurylpyrone derivatives TEIJIN LIMITED, MICROBIAL CHEMISTRY RESEARCH FOUNDATION 2003-10-02 — — US disclosed
US-6589984-B1 Blood cholesterol and triglycerides (TG) themselves are generally insoluble in blood, and they exist as lipoproteins by binding with apolipoproteins. In the body, triglycerides are biosynthesized primarily in the liver from acetyl CoA as TEIJIN LIMITED (JP) 2003-07-08 — — US disclosed
EP-1063235-A1 BENZOFURYLPYRONE DERIVATIVES TEIJIN LIMITED (JP) 2000-12-27 — — EP 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-20030186976-A1 Benzofurylpyrone derivatives PLIN5, ACSL5, PLIN1 NAT1 424/4885CA2 3747/4885EPHX1 3382/4885

“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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