SCHEMBL2808172

SCHEMBL2808172

O=C(O)/C(=C/Sc1ccccc1)c1cccs1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.48
HPGDS O60760 1/20 0.47
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
MAPT P10636 3/20 0.45
MAPK1 P28482 2/20 0.45
TP53 P04637 1/20 0.45
LMNA P02545 3/20 0.44
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
ALOX15 P16050 1/20 0.44
RAB9A P51151 4/20 0.42
ALDH1A1 P00352 4/20 0.42
NPC1 O15118 3/20 0.42
POLB P06746 3/20 0.42
HDAC1 Q13547 1/20 0.42
GPR52 Q9Y2T5 1/20 0.40
GSK3B P49841 1/20 0.40

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
SCHEMBL2808173 1.00 DAO (0.48) DAOHPGDSCES2CES1KMT2A
SCHEMBL2813273 0.88 DAO (0.43) DAOHPGDSCES2CES1KMT2A
SCHEMBL2813275 0.88 DAO (0.43) DAOHPGDSCES2CES1KMT2A
SCHEMBL2812942 0.83 DAO (0.42) DAOHPGDSCES2CES1KMT2A
SCHEMBL2812946 0.83 DAO (0.42) DAOHPGDSCES2CES1KMT2A
SCHEMBL2809793 0.82 NPC1 (0.51) DAOKMT2AMEN1MAPTMAPK1
SCHEMBL2809794 0.82 NPC1 (0.51) DAOKMT2AMEN1MAPTMAPK1
SCHEMBL3036930 0.82 NPC1 (0.51) DAOKMT2AMEN1MAPTMAPK1
SCHEMBL2809102 0.75 NOS1 (0.47) DAOHPGDSKMT2AMEN1MAPT
SCHEMBL2809103 0.75 NOS1 (0.47) DAOHPGDSKMT2AMEN1MAPT

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-8278473-B2 Alpha, beta-unsaturated imidate compound and pesticidal composition containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-10-02 US disclosed
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
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 DAO 549/4885HPGDS 1856/4885CES2 2038/4885

“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.