SCHEMBL3528612

SCHEMBL3528612

COCC(=O)Nc1cccc(/C=C/C(=O)c2c(O)c3ccccc3oc2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 6/20 0.56
MAPT P10636 6/20 0.56
KMT2A Q03164 5/20 0.56
KDM4E B2RXH2 4/20 0.56
CYP1A2 P05177 3/20 0.56
CYP2C19 P33261 3/20 0.56
CYP2C9 P11712 2/20 0.56
MEN1 O00255 3/20 0.54
RAB9A P51151 2/20 0.54
RECQL P46063 1/20 0.54
GPR55 Q9Y2T6 1/20 0.54
HSD17B10 Q99714 3/20 0.46
GAA P10253 3/20 0.46
HPGD P15428 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
TSHR P16473 1/20 0.46
ALDH1A1 P00352 4/20 0.44
ALOX15 P16050 2/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL3528614 1.00 NQO1 (0.56) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL3528351 0.90 CA12 (0.47) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL3528353 0.90 CA12 (0.47) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL3528533 0.86 NQO1 (0.54) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL3528531 0.86 NQO1 (0.54) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL3530871 0.85 MAPT (0.41) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL3530873 0.85 MAPT (0.41) NQO1MAPTKMT2AKDM4ECYP1A2
SCHEMBL13403229 0.82 MAPT (0.58) NQO1MAPTKMT2AKDM4EMEN1
SCHEMBL3530413 0.82 MAPT (0.58) NQO1MAPTKMT2AKDM4EMEN1
SCHEMBL2277561 0.81 RAB9A (0.51) KMT2AKDM4EMEN1RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691883-B2 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-06 US disclosed
US-7691883-B2 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-06 US disclosed
US-7691883-B2 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-06 US disclosed
US-20070265228-A1 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US disclosed
US-20070265228-A1 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US disclosed
US-20070265228-A1 Cinnamoyl compound and use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-11-15 US disclosed
EP-1671961-A1 CINNAMOYL COMPOUND AND USE OF THE SAME Sumitomo Chemical Company, Limited (JP) 2006-06-21 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-20070265228-A1 Cinnamoyl compound and use of the same NPC1, CES2, CYP51A1 NQO1 143/4885MAPT 2195/4885KMT2A 3443/4885

“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.