SCHEMBL14537236

SCHEMBL14537236

COC(C)CC1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 10/20 0.45
▸ CTSL P07711 7/20 0.42
▸ CTSB P07858 7/20 0.42
▸ CTSH P09668 5/20 0.41
▸ LTA4H P09960 1/20 0.35
▸ CYP1A2 P05177 1/20 0.34

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
SCHEMBL11239152 0.98 CTSK (0.42) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL11231610 0.83 CTSK (0.47) CTSKCTSLCTSBCTSHCYP1A2
SCHEMBL192070 0.83 CTSK (0.47) CTSKCTSLCTSBCTSHCYP1A2
SCHEMBL191969 0.80 CTSK (0.45) CTSKCTSLCTSBCTSHCYP1A2
SCHEMBL15279313 0.79 CTSK (0.45) CTSKCTSLCTSBCTSH
SCHEMBL16590926 0.79 CTSK (0.45) CTSKCTSLCTSBCTSH
SCHEMBL9205347 0.78 CYP1A2 (0.36) CTSKCTSLCTSBCTSHCYP1A2
SCHEMBL16590939 0.77 CTSK (0.42) CTSKCTSLCTSBCTSHCYP1A2
SCHEMBL28997818 0.77 CTSK (0.36) CTSKCTSLCTSBCTSHLTA4H
SCHEMBL7516459 0.77 CPN1 (0.39) CTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2017060854-A1 BIARYL PYRAZOLES AS NRF2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-04-13 — — WO disclosed
EP-3037880-A1 LAMINATE BODY Fujifilm Corporation (JP) 2016-06-29 — — EP disclosed
US-20070122444-A1 Medical devices employing triazine compounds and compositions thereof DR. REDDY'S LABORATORIES LTD. (IN) 2007-05-31 — — 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-20070122444-A1 Medical devices employing triazine compounds and compositions thereof AREG, TGFB1, TGFB2 CTSK 2950/4885CTSL 2958/4885CTSB 2344/4885

“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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