SCHEMBL6719581

SCHEMBL6719581

COC(=O)C(C#N)=C(C)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.41
ALDH1A1 P00352 6/20 0.39
KDM4E B2RXH2 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAPK10 P53779 3/20 0.32
HPGD P15428 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 4/20 0.30
APP P05067 1/20 0.30
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
GAA P10253 1/20 0.30
CYP2C9 P11712 1/20 0.30
PKM P14618 1/20 0.30
ALOX15 P16050 1/20 0.30
LMNA P02545 1/20 0.30
THRB P10828 1/20 0.30
BLM P54132 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
SCHEMBL6719577 1.00 IDO1 (0.41) IDO1ALDH1A1KDM4EL3MBTL1MAPK10
SCHEMBL2773358 0.83 IDO1 (0.42) IDO1ALDH1A1L3MBTL1MAPK10HPGD
SCHEMBL8783520 0.81 ALDH1A1 (0.46) IDO1ALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL17139814 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1TSHRMEN1
SCHEMBL4959620 0.81 ALDH1A1 (0.46) IDO1ALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL4714434 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1TSHRMEN1
SCHEMBL4714435 0.81 ALDH1A1 (0.50) ALDH1A1KDM4EL3MBTL1TSHRMEN1
SCHEMBL4959625 0.81 ALDH1A1 (0.46) IDO1ALDH1A1KDM4EL3MBTL1TSHR
SCHEMBL15661204 0.81 ALDH1A1 (0.35) IDO1ALDH1A1L3MBTL1MAPK10HPGD
SCHEMBL19071358 0.81 IDO1 (0.41) IDO1ALDH1A1L3MBTL1MAPK10TSHR

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-20040092402-A1 Pyrimidine derivatives and herbicides containing the same SUMITOMO CHEMICAL TAKEDA AGRO COMPANY, LIMITED (JP) 2004-05-13 US disclosed
EP-1333029-A1 PYRIMIDINE DERIVATIVES AND HERBICIDES CONTAINING THE SAME Sumitomo Chemical Takeda Agro Company, Limited (JP) 2003-08-06 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-20040092402-A1 Pyrimidine derivatives and herbicides containing the same DDX41, CBR3, DPYD IDO1 1292/4885ALDH1A1 83/4885KDM4E 1493/4885

“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.