SCHEMBL8848780

SCHEMBL8848780

C#CCOCC(C)(C)COCC#C

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL25726671 0.87 CYP2D6 (0.36)
SCHEMBL15806527 0.85 TSHR (0.32) TSHRMAPK1
SCHEMBL6141036 0.83
SCHEMBL20130263 0.83 MEN1 (0.33) TSHRMEN1ALDH1A1KMT2A
SCHEMBL23415583 0.82
SCHEMBL15803969 0.80 TSHR (0.34) TSHR
SCHEMBL18250965 0.79 MEN1 (0.31) TSHRMEN1ALDH1A1KMT2A
SCHEMBL3224210 0.79
SCHEMBL15803975 0.78 GSTP1 (0.42) TSHR
SCHEMBL23415572 0.78 CA2 (0.31)

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
US-20180126011-A1 DENDRI-TAC AND THEIR USE AS THERANOSTICS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2018-05-10 US disclosed
US-20140170405-A1 PROCESSES FOR PREPARING CURED FILMS, THE RESULTING FILMS, AND PLASMA-INITIATED POLYMERIZABLE COMPOSITIONS FUJIFILM CORPORATION (JP) 2014-06-19 US disclosed
EP-0534465-B1 Curable resin composition NIPPON PAINT CO LTD (JP) 1997-08-27 EP disclosed
US-5324807-A Resin having a plurality of alkynyl groups, an organohydrogenpolysiloxane and a platimum catalyst SHIN-ETSU CHEMICAL CO., LTD. (JP) 1994-06-28 US disclosed
EP-0534465-A2 Curable resin composition NIPPON PAINT COMPANY LIMITED (JP) 1993-03-31 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-20180126011-A1 DENDRI-TAC AND THEIR USE AS THERANOSTICS DBI, CDIPT, DGKI TSHR 973/4885MAPK1 4821/4885MEN1 2906/4885

“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.