SCHEMBL1784345

SCHEMBL1784345

CCCCC(CC)CC(CC(CC)CCCC)n1c2cc([Sn](C)(C)C)sc2c2sc([Sn](C)(C)C)cc21

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL4534771 0.81 ALDH1A1 (0.34) ALDH1A1TDP1
SCHEMBL15968434 0.81 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL4522784 0.72 TSHR (0.36) ALDH1A1TDP1
SCHEMBL861463 0.71 ALDH1A1 (0.33) ALDH1A1TDP1
SCHEMBL1498228 0.70 ALDH1A1 (0.32) ALDH1A1TDP1
SCHEMBL16252155 0.69 KCNH2 (0.34) ALDH1A1TDP1
SCHEMBL3019106 0.68 CYP3A4 (0.36) ALDH1A1TDP1
SCHEMBL29140073 0.67 PSEN1 (0.35) ALDH1A1
SCHEMBL2396262 0.67 PSEN1 (0.35) ALDH1A1
SCHEMBL15392985 0.67 ALDH1A1 (0.34) ALDH1A1TDP1

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
US-8968885-B2 Organic electronic devices and polymers, including photovoltaic cells and diketone-based polymers SOLVAY USA, INC. (US) 2015-03-03 — — US disclosed
US-20110204341-A1 ORGANIC ELECTRONIC DEVICES AND POLYMERS, INCLUDING PHOTOVOLTAIC CELLS AND DIKETONE-BASED POLYMERS PLEXTRONICS, INC. 2011-08-25 — — US disclosed
US-20110114184-A1 ORGANIC ELECTRONIC DEVICES AND POLYMERS, INCLUDING PHOTOVOLTAIC CELLS AND DIKETONE-BASED AND DIKETOPYRROLOPYRROLE-BASED POLYMERS PLEXTRONICS, INC. 2011-05-19 — — US disclosed
US-20090221740-A1 NOVEL COMPOSITIONS, METHODS, AND POLYMERS PLEXTRONICS, INC. 2009-09-03 — — 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-20110114184-A1 ORGANIC ELECTRONIC DEVICES AND POLYMERS, INCLUDING PHOTOVOLTAIC CELLS AND DIKETONE-BASED AND DIKETOPYRROLOPYRROLE-BASED POLYMERS CCNE2, PIN1, TPRKB ALDH1A1 1556/4885TDP1 1710/4885

“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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