SCHEMBL921365

SCHEMBL921365

CC/C=C/CCCOc1cc[c]cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
NR1I2 O75469 1/20 0.37
PGR P06401 1/20 0.37
PTGS2 P35354 1/20 0.37
PDE4D Q08499 1/20 0.37
NQO1 P15559 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LTA4H P09960 2/20 0.34
LPAR2 Q9HBW0 3/20 0.34
LPAR3 Q9UBY5 3/20 0.34
LPAR1 Q92633 1/20 0.34
F7 P08709 1/20 0.33
CYP19A1 P11511 1/20 0.33

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
SCHEMBL921366 1.00 ALDH1A1 (0.37) ALDH1A1KDM4ESMN1; SMN2ADORA3NR1I2
SCHEMBL920189 0.91 CDK1 (0.36) ALDH1A1KDM4ESMN1; SMN2NQO1LTA4H
SCHEMBL920188 0.91 CDK1 (0.36) ALDH1A1KDM4ESMN1; SMN2NQO1LTA4H
SCHEMBL921234 0.84 KCNA3 (0.34) ALDH1A1KDM4ESMN1; SMN2NQO1LTA4H
SCHEMBL921232 0.84 KCNA3 (0.34) ALDH1A1KDM4ESMN1; SMN2NQO1LTA4H
SCHEMBL920745 0.80 LTA4H (0.34) ALDH1A1ADORA3NR1I2PGRPTGS2
SCHEMBL920744 0.80 LTA4H (0.34) ALDH1A1ADORA3NR1I2PGRPTGS2
SCHEMBL920367 0.80 LTA4H (0.35) KDM4ESMN1; SMN2CYP3A4LTA4HCYP19A1
SCHEMBL920365 0.80 LTA4H (0.35) KDM4ESMN1; SMN2CYP3A4LTA4HCYP19A1
SCHEMBL921750 0.79 AOC3 (0.41) NQO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed
US-20090318610-A1 ORGANIC INSULATING MATERIALS, VARNISHES FOR ORGANIC INSULATING FILM EMPLOYING THEM, ORGANIC INSULATING FILMS AND SEMICONDUCTOR DEVICES SUMITOMO BAKELITE CO., LTD (JP) 2009-12-24 US disclosed
EP-2117009-A1 ORGANIC INSULATING MATERIAL, VARNISH FOR ORGANIC INSULATING FILM USING THE SAME, ORGANIC INSULATING FILM AND SEMICONDUCTOR DEVICE Sumitomo Bakelite Co., Ltd. (JP) 2009-11-11 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 (2 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 ALDH1A1 2743/4885KDM4E 3657/4885SMN1; SMN2 4796/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 ALDH1A1 4326/4885KDM4E 3733/4885SMN1; SMN2 4604/4885

“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.