SCHEMBL2752554

SCHEMBL2752554

O=Cc1c(C=O)c2cc3nc(cc4ccc(cc5nc(cc1[nH]2)C=C5)[nH]4)C=C3

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.36
▸ STAT1 P42224 1/20 0.36
▸ CYP2A6 P11509 1/20 0.34
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ KMT2A Q03164 1/20 0.31

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
SCHEMBL1595495 0.83 STAT3 (0.44) STAT3STAT1CYP2A6
SCHEMBL352669 0.82 STAT3 (0.47) STAT3STAT1CYP2A6
SCHEMBL3447559 0.82 STAT3 (0.36) STAT3STAT1
SCHEMBL29267780 0.81 STAT3 (0.36) STAT3STAT1
SCHEMBL27728578 0.81 STAT3 (0.36) STAT3STAT1
Formic Acid SCHEMBL27490312 0.81 STAT3 (0.36) STAT3STAT1
SCHEMBL6744970 0.80 STAT3 (0.42) STAT3STAT1
SCHEMBL9430673 0.80 STAT3 (0.42) STAT3STAT1
SCHEMBL29430977 0.80 STAT3 (0.42) STAT3STAT1
SCHEMBL6517023 0.80 STAT3 (0.42) STAT3STAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106455705-A Methods and devices for smoking urge relief 方特慕控股第私人有限公司 2017-02-22 — — CN disclosed
CN-104955508-A Methods and devices for compound delivery NICOTINE TECHNOLOGY INC E 2015-09-30 — — CN disclosed
CN-204147375-U Be designed for the aerosol generation equipment producing condensation aerosol NICOTINE TECHNOLOGY INC E 2015-02-11 — — CN disclosed
CN-101866755-B Molecular device, imaging device, photosensor, and electronic apparatus SONY CORP 2012-09-26 — — CN disclosed
US-8178872-B2 Molecular device, imaging device, photosensor, and electronic apparatus SONY CORPORATION (JP) 2012-05-15 — — US disclosed
US-20100264409-A1 MOLECULAR DEVICE, IMAGING DEVICE, PHOTOSENSOR, AND ELECTRONIC APPARATUS SONY CORPORATION (JP) 2010-10-21 — — US disclosed
CN-101866755-A Molecular device, image device, optical sensor and electronic equipment SONY CORP 2010-10-20 — — CN disclosed
US-20080283122-A1 Beta-Substituted Porphyrins CAMPBELL WAYNE MASON 2008-11-20 — — US disclosed
US-20070142290-A1 SURFACE-MODIFIED SERUM ALBUMIN-METAL PORPHYRIN COMPOSITE, AND OXYGEN INFUSION SOLUTION CONTAINING THE SAME EISHUN TSUCHIDA (JP) 2007-06-21 — — US disclosed
EP-1792917-A1 SURFACE-MODIFIED SERUM ALBUMIN-METAL PORPHYRIN COMPOSITE, AND OXYGEN INFUSION CONTAINING THE SAME Tsuchida, Eishun (JP) 2007-06-06 — — 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 (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-20080283122-A1 Beta-Substituted Porphyrins PPOX, HMBS, CRY1 STAT3 3336/4885STAT1 4389/4885CYP2A6 2795/4885
US-20070142290-A1 SURFACE-MODIFIED SERUM ALBUMIN-METAL PORPHYRIN COMPOSITE, AND OXYGEN INFUSION SOLUTION CONTAINING THE SAME ALB, TFRC, MB STAT3 563/4885STAT1 2004/4885CYP2A6 1014/4885

“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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