SCHEMBL1614211

SCHEMBL1614211

C#CC(C)(O)c1ccc(C)o1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.40
HTR1A P08908 1/20 0.31
HTR7 P34969 1/20 0.31
HTR6 P50406 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
SCHEMBL2735690 0.78 TDP1 (0.48) TDP1HTR1AHTR7HTR6
SCHEMBL1613694 0.72 ALOX5 (0.30) TDP1
SCHEMBL420157 0.72 TDP1 (0.53) TDP1HTR1AHTR7HTR6
SCHEMBL19681462 0.72 TDP1 (0.53) TDP1HTR1AHTR7HTR6
SCHEMBL1613425 0.69 MAPT (0.47)
SCHEMBL17327470 0.69 TDP1 (0.39) TDP1HTR1AHTR7HTR6
SCHEMBL4750524 0.69 TDP1 (0.30) TDP1
SCHEMBL1613967 0.68 KDM4E (0.31)
SCHEMBL17210661 0.67 MEN1 (0.39) TDP1HTR6
SCHEMBL15194040 0.67 HCAR2 (0.36)

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
EP-2315751-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS Amgen Inc. (US) 2011-05-04 EP disclosed
US-20110086834-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS AMGEN INC. (US) 2011-04-14 US disclosed
WO-2009158011-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS AMGEN INC. (US) 2009-12-30 WO 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-20110086834-A1 ALKYNYL ALCOHOLS AS KINASE INHIBITORS NFKBIA, MAP3K1, MAP3K2 TDP1 925/4885HTR1A 4296/4885HTR7 4146/4885

“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.