SCHEMBL3040573

SCHEMBL3040573

O=C(C=CSc1ccccc1)Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.64
MAPT P10636 4/20 0.64
KDM4E B2RXH2 2/20 0.64
LPAR2 Q9HBW0 1/20 0.56
LPAR3 Q9UBY5 1/20 0.56
LMNA P02545 3/20 0.50
HTT P42858 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
PLIN1 O60240 1/20 0.50
HPGD P15428 1/20 0.50
PLIN5 Q00G26 1/20 0.50
ABHD5 Q8WTS1 1/20 0.50
PTPN1 P18031 2/20 0.49
PTPN11 Q06124 1/20 0.49
MMP1 P03956 5/20 0.46
MMP2 P08253 5/20 0.46
MMP9 P14780 5/20 0.46
EGFR P00533 4/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46

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
SCHEMBL4648073 0.90 MAPT (0.56) ALDH1A1MAPTKDM4ELPAR2LMNA
SCHEMBL9277123 0.90 MAPT (0.56) ALDH1A1MAPTKDM4ELPAR2LMNA
SCHEMBL3986444 0.90 MAPT (0.56) ALDH1A1MAPTKDM4ELPAR2LMNA
SCHEMBL4646465 0.86 MAOA (0.51) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL3035627 0.86 MMP1 (0.61) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL4647289 0.86 MMP1 (0.61) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL4644727 0.86 MAPT (0.61) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL3035626 0.86 MMP1 (0.61) ALDH1A1MAPTKDM4ELMNAHTT
SCHEMBL4648121 0.84 ALDH1A1 (0.67) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL4649079 0.82 MMP1 (0.64) ALDH1A1MAPTLMNANPSR1MMP1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8318981-B2 Imidate compound and use thereof for pest control SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-11-27 US disclosed
US-20100210683-A1 IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-08-19 US disclosed
EP-2183215-A2 IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2010-05-12 EP disclosed
WO-2009014267-A2 IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-01-29 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-20100210683-A1 IMIDATE COMPOUND AND USE THEREOF FOR PEST CONTROL CYP1A1, CYC1, C1S ALDH1A1 398/4885MAPT 4511/4885KDM4E 1787/4885

“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.