SCHEMBL920746

SCHEMBL920746

CCCOc1ccc(Oc2ccc(CNC(=O)c3ccc(C)nc3N)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 3/20 0.45
TSHR P16473 1/20 0.45
CHRNB2 P17787 1/20 0.44
CHRNB4 P30926 1/20 0.44
CHRNA3 P32297 1/20 0.44
CHRNA4 P43681 1/20 0.44
ADORA2A P29274 2/20 0.44
ADORA1 P30542 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KLKB1 P03952 1/20 0.43
KLK1 P06870 1/20 0.43
HDAC1 Q13547 1/20 0.43
MAPK14 Q16539 2/20 0.42
TP53 P04637 1/20 0.42
MMP2 P08253 1/20 0.41
CYP3A4 P08684 1/20 0.41
STAT3 P40763 1/20 0.41

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
SCHEMBL922028 0.96 LMNA (0.51) SMN1; SMN2LMNAPOLBADORA2AADORA1
SCHEMBL922051 0.92 HDAC1 (0.45) SMN1; SMN2LMNAPOLBTSHRCHRNB2
SCHEMBL922072 0.91 POLB (0.54) SMN1; SMN2LMNAPOLBADORA2AADORA1
SCHEMBL921458 0.89 ADORA2A (0.45) SMN1; SMN2POLBTSHRADORA2AADORA1
SCHEMBL920860 0.89 ALDH1A1 (0.47) ADORA2AADORA1HDAC1MAPK14HTT
SCHEMBL921155 0.89 ADORA2A (0.47) SMN1; SMN2POLBADORA2AADORA1NPC1
SCHEMBL922078 0.88 FAAH (0.45) SMN1; SMN2LMNAPOLBTSHRNPC1
SCHEMBL923423 0.88 TP53 (0.46) SMN1; SMN2LMNAPOLBNPC1RAB9A
SCHEMBL920695 0.88 MAPK14 (0.55) SMN1; SMN2ADORA2AADORA1MAPK14MMP2
SCHEMBL920682 0.87 ADORA2A (0.44) SMN1; SMN2LMNAPOLBADORA2AADORA1

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 SMN1; SMN2 4796/4885LMNA 4812/4885POLB 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.