SCHEMBL921155

SCHEMBL921155

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.47
ADORA1 P30542 2/20 0.47
POLB P06746 1/20 0.46
MAPK14 Q16539 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
MMP13 P45452 2/20 0.44
MMP2 P08253 1/20 0.44
CYP3A4 P08684 1/20 0.44
STAT3 P40763 1/20 0.44
HTT P42858 1/20 0.44
CHRM4 P08173 2/20 0.43
FLT1 P17948 1/20 0.43
LRRK2 Q5S007 1/20 0.43
ALDH1A1 P00352 2/20 0.43
LIPG Q9Y5X9 1/20 0.42
HPGD P15428 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL920695 0.92 MAPK14 (0.55) ADORA2AADORA1MAPK14SMN1; SMN2MMP13
SCHEMBL922072 0.91 POLB (0.54) ADORA2AADORA1POLBSMN1; SMN2HPGD
SCHEMBL921458 0.91 ADORA2A (0.45) ADORA2AADORA1POLBMAPK14SMN1; SMN2
SCHEMBL921286 0.91 ADORA2A (0.57) ADORA2AADORA1POLBSMN1; SMN2CYP3A4
SCHEMBL919964 0.91 MAPK14 (0.57) ADORA2AADORA1MAPK14SMN1; SMN2MMP13
SCHEMBL919767 0.90 MMP13 (0.46) MAPK14MMP13CHRM4FLT1LRRK2
SCHEMBL921033 0.89 ADORA2A (0.53) ADORA2AADORA1MAPK14SMN1; SMN2CYP3A4
SCHEMBL922074 0.89 ADORA2A (0.46) ADORA2AADORA1MAPK14SMN1; SMN2MMP13
SCHEMBL919972 0.89 ADORA2A (0.46) ADORA2AADORA1POLBMAPK14SMN1; SMN2
SCHEMBL920459 0.89 LIPG (0.55) ADORA2AADORA1MAPK14SMN1; SMN2CYP3A4

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 ADORA2A 4433/4885ADORA1 3433/4885POLB 4159/4885

“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.