SCHEMBL23009385

SCHEMBL23009385

CC(C)C(=O)CC(=O)C1(C(F)(F)F)CCCCC1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.35
DGAT1 O75907 1/20 0.35
USP21 Q9UK80 2/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C8 P10632 1/20 0.30
CYP2D6 P10635 1/20 0.30
ACHE P22303 1/20 0.30
MAPKAPK5 Q8IW41 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
SCHEMBL23009435 0.83 DGAT1 (0.33) RIPK1DGAT1
SCHEMBL23009522 0.83 DGAT1 (0.43) RIPK1DGAT1
SCHEMBL23009388 0.80 DGAT1 (0.33) RIPK1DGAT1USP21CYP3A4CYP2C8
SCHEMBL23009395 0.80 DGAT1 (0.33) DGAT1
SCHEMBL23009394 0.79 DGAT1 (0.30) DGAT1
SCHEMBL23009434 0.77 DGAT1 (0.36) RIPK1DGAT1
SCHEMBL23009404 0.77 MME (0.31)
SCHEMBL23009397 0.77 DGAT1 (0.38) RIPK1DGAT1
SCHEMBL15113210 0.74 DGAT1 (0.38) RIPK1DGAT1
SCHEMBL23009436 0.73 DGAT1 (0.33) RIPK1DGAT1

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-20210047354-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-02-18 US disclosed
EP-3778614-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2021-02-17 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-20210047354-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES L1CAM, LEF1, EPCAM RIPK1 4110/4885DGAT1 1546/4885USP21 4838/4885

“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.