SCHEMBL12408348

SCHEMBL12408348

CCCCCCc1ccsc1B1OCC(C)(C)CO1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 6/20 0.37
▸ LPL P06858 5/20 0.37
▸ ACE2 Q9BYF1 1/20 0.33
▸ CYSLTR2 Q9NS75 2/20 0.33
▸ CYSLTR1 Q9Y271 2/20 0.33
▸ TYR P14679 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ GPR35 Q9HC97 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
SCHEMBL27946363 0.85 LPL (0.42) LIPGLPLCYSLTR2CYSLTR1
SCHEMBL16139822 0.82 LIPG (0.52) LIPGLPLACE2CYSLTR2CYSLTR1
SCHEMBL1108971 0.82 LIPG (0.52) LIPGLPLACE2CYSLTR2CYSLTR1
SCHEMBL12264421 0.82 LIPG (0.52) LIPGLPLACE2CYSLTR2CYSLTR1
SCHEMBL30460 0.82 LIPG (0.52) LIPGLPLACE2CYSLTR2CYSLTR1
SCHEMBL12610496 0.82 LIPG (0.52) LIPGLPLACE2CYSLTR2CYSLTR1
SCHEMBL20037354 0.76 LIPG (0.44) LIPGLPLCYSLTR2CYSLTR1TYR
SCHEMBL12407973 0.76 LPL (0.30) LIPGLPLACE2
SCHEMBL12890197 0.76 LIPG (0.38) LIPGLPLACE2TYRMEN1
SCHEMBL12651429 0.75 LIPG (0.37) LIPGLPLCYSLTR2CYSLTR1

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-7973172-B2 Organic compound, semiconductor film electrode employing the organic compound, photoelectric conversion element employing the organic compound, and photoelectrochemical solar cell employing the organic compound NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2011-07-05 — — US disclosed
US-20100174095-A1 ORGANIC COMPOUND, SEMICONDUCTOR FILM ELECTRODE EMPLOYING THE ORGANIC COMPOUND, PHOTOELECTRIC CONVERSION ELEMENT EMPLOYING THE ORGANIC COMPOUND, AND PHOTOELECTROCHEMICAL SOLAR CELL EMPLOYING THE ORGANIC COMPOUND NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2010-07-08 — — 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-20100174095-A1 ORGANIC COMPOUND, SEMICONDUCTOR FILM ELECTRODE EMPLOYING THE ORGANIC COMPOUND, PHOTOELECTRIC CONVERSION ELEMENT EMPLOYING THE ORGANIC COMPOUND, AND PHOTOELECTROCHEMICAL SOLAR CELL EMPLOYING THE ORGANIC COMPOUND HCN3, HCN4, HCN2 LIPG 2969/4885LPL 4095/4885ACE2 3311/4885

“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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