SCHEMBL2808186

SCHEMBL2808186

COC(=O)C(=CSc1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.45
LMNA P02545 6/20 0.45
MAPT P10636 5/20 0.45
NPSR1 Q6W5P4 4/20 0.45
HPGD P15428 3/20 0.45
HTT P42858 2/20 0.45
PLIN1 O60240 1/20 0.45
PLIN5 Q00G26 1/20 0.45
ABHD5 Q8WTS1 1/20 0.45
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
AKR1C1 Q04828 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 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
SCHEMBL12851372 1.00 ALDH1A1 (0.45) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL2808184 1.00 ALDH1A1 (0.45) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL2815447 0.84 HPGD (0.42) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL3041499 0.84 HPGD (0.42) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL2815445 0.84 HPGD (0.42) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL9736438 0.83 TSHR (0.47) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL9736440 0.83 TSHR (0.47) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL9736444 0.83 TSHR (0.47) ALDH1A1LMNAMAPTNPSR1HPGD
SCHEMBL2812942 0.80 DAO (0.42) ALDH1A1MAPTHPGDTSHRSMN1; SMN2
SCHEMBL2812946 0.80 DAO (0.42) ALDH1A1MAPTHPGDTSHRSMN1; SMN2

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 ALDH1A1 405/4885LMNA 2201/4885MAPT 4608/4885

“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.