SCHEMBL2909076

SCHEMBL2909076

CCC1(COC(=O)CC#N)COC1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CTSK P43235 4/20 0.33
PRKCA P17252 1/20 0.32
POLB P06746 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MCL1 Q07820 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
SCHEMBL12263773 0.81 TSHR (0.48) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL3462896 0.81 TSHR (0.45) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL2911146 0.80 EPHX1 (0.36) MCL1
SCHEMBL10071407 0.80 TSHR (0.45) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL25667500 0.79 TSHR (0.44) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL9894576 0.78 PRKCA (0.49) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL17363977 0.78 TSHR (0.46) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL10071397 0.78 TSHR (0.43) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL19105141 0.77 TSHR (0.40) TSHRMEN1KMT2ACTSKPRKCA
SCHEMBL1813100 0.77 TSHR (0.47) TSHRMEN1KMT2ACTSKPRKCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2217557-B1 ACTIVATED METHYLENE REAGENTS Henkel IP & Holding GmbH (DE) 2018-01-24 EP disclosed
US-8481755-B2 Activated methylene reagents and curable compositions prepared therefrom HENKEL IRELAND LTD. (DE) 2013-07-09 US disclosed
EP-2217557-A2 ACTIVATED METHYLENE REAGENTS AND CURABLE COMPOSITIONS PREPARED THEREFROM Loctite (R & D) Limited (IE) 2010-08-18 EP disclosed
US-20100199888-A1 ACTIVATED METHYLENE REAGENTS AND CURABLE COMPOSITIONS PREPARED THEREFROM LOCTITE (R&D) LIMITED (IE) 2010-08-12 US disclosed
WO-2009053482-A2 ACTIVATED METHYLENE REAGENTS AND CURABLE COMPOSITIONS PREPARED THEREFROM LOCTITE (R & D) LIMITED (IE) 2009-04-30 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-20100199888-A1 ACTIVATED METHYLENE REAGENTS AND CURABLE COMPOSITIONS PREPARED THEREFROM NOTUM, WASF2, BHMT2 TSHR 4729/4885MEN1 2833/4885KMT2A 1499/4885

“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.