SCHEMBL2809896

SCHEMBL2809896

O=C(O)/C(=C/Sc1ccc(F)cc1)c1ccsc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
LCK P06239 1/20 0.42
FYN P06241 1/20 0.42
DAO P14920 1/20 0.42
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
HDAC1 Q13547 1/20 0.36
ALDH1A1 P00352 3/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 1/20 0.35
POLB P06746 3/20 0.35
GPR52 Q9Y2T5 1/20 0.33
PTGS2 P35354 1/20 0.33
AKR1C2 P52895 1/20 0.33
AKR1C1 Q04828 1/20 0.33
AKR1C3 P42330 1/20 0.33
HSD11B1 P28845 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL2809899 1.00 MEN1 (0.43) MEN1KMT2ALCKFYNDAO
SCHEMBL2811436 0.87 LCK (0.46) LCKFYNDAOCES2CES1
SCHEMBL2811434 0.87 LCK (0.46) LCKFYNDAOCES2CES1
SCHEMBL2813477 0.84 MEN1 (0.42) MEN1KMT2ALCKFYNDAO
SCHEMBL2813475 0.84 MEN1 (0.42) MEN1KMT2ALCKFYNDAO
SCHEMBL2811124 0.82 HPGD (0.49) MEN1KMT2AALDH1A1HTTHPGD
SCHEMBL2811122 0.82 HPGD (0.49) MEN1KMT2AALDH1A1HTTHPGD
SCHEMBL2808679 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL2808680 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL12850792 0.76 MEN1 (0.32) MEN1KMT2A

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
US-8278473-B2 Alpha, beta-unsaturated imidate compound and pesticidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-02 US disclosed
US-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-09-23 US disclosed
WO-2009064031-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-05-22 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-20100240729-A1 ALPHA, BETA-UNSATURATED IMIDATE COMPOUND AND PESTICIDAL COMPOSITION CONTAINING THE SAME OXER1, CBR1, DEGS1 MEN1 3112/4885KMT2A 3324/4885LCK 3873/4885

“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.