SCHEMBL919835

SCHEMBL919835

CC(C)CCc1ccc(Oc2ccc(CNC(=O)c3ccc(F)nc3N)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.43
MAPK14 Q16539 3/20 0.40
CYP3A4 P08684 2/20 0.40
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
PTGER4 P35408 3/20 0.39
PTGER2 P43116 1/20 0.39
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
POLB P06746 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
MAPK1 P28482 4/20 0.38
MMP13 P45452 2/20 0.38
MMP2 P08253 1/20 0.38
STAT3 P40763 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL920096 0.92 PPARG (0.41) MAPK14PPARGPPARDPPARAMAPK1
SCHEMBL921959 0.90 CARM1 (0.43) LIPGMAPK14PPARGPPARDPPARA
SCHEMBL921525 0.89 LIPG (0.44) LIPGMAPK14CYP3A4PPARGPPARD
SCHEMBL921492 0.88 ADORA2A (0.43) LIPGMAPK14CYP3A4CARM1PRMT6
SCHEMBL919844 0.88 LIPG (0.45) LIPGMAPK14CYP3A4PPARGPPARD
SCHEMBL919828 0.86 LIPG (0.43) LIPGMAPK14CYP3A4PPARGPPARD
SCHEMBL920140 0.86 EGLN1 (0.51) LIPGEGLN1SMN1; SMN2
SCHEMBL921095 0.86 LIPG (0.47) LIPGMAPK14CYP3A4PPARGPPARD
SCHEMBL921316 0.86 MAPK14 (0.53) LIPGMAPK14CYP3A4PTGER4MMP13
SCHEMBL920506 0.86 CYP3A4 (0.54) LIPGMAPK14CYP3A4PPARGPPARD

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 LIPG 3664/4885MAPK14 905/4885CYP3A4 3076/4885

“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.