SCHEMBL922029

SCHEMBL922029

CCCC(C)c1cccc(Oc2ccc(CNC(=O)c3ccc(C)nc3N)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.40
PPARA Q07869 5/20 0.40
PPARD Q03181 2/20 0.40
MAPK14 Q16539 1/20 0.40
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CA2 P00918 1/20 0.38
CA4 P22748 1/20 0.38
EPHX2 P34913 1/20 0.38
ADORA2A P29274 2/20 0.38
ADORA1 P30542 1/20 0.38
KLK1 P06870 3/20 0.38
KLKB1 P03952 2/20 0.38
MAPK1 P28482 3/20 0.38
CHRM4 P08173 2/20 0.37
FLT1 P17948 1/20 0.37
LRRK2 Q5S007 1/20 0.37
MMP13 P45452 1/20 0.37
GALR3 O60755 1/20 0.37

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
SCHEMBL921964 0.91 ADORA2A (0.41) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL920073 0.90 PPARG (0.40) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL920414 0.88 PPARG (0.44) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL919827 0.88 MAPK14 (0.42) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL922811 0.88 PPARG (0.40) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL920081 0.86 MAPK8 (0.46) PPARGPPARAPPARDALDH1A1LMNA
SCHEMBL920232 0.84 MMP13 (0.44) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL919767 0.84 MMP13 (0.46) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL920420 0.84 MAPK14 (0.49) PPARGPPARAPPARDMAPK14ALDH1A1
SCHEMBL919230 0.84 MMP13 (0.42) PPARGPPARAPPARDMAPK14ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 PPARG 391/4885PPARA 494/4885PPARD 360/4885

“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.