SCHEMBL3495645

SCHEMBL3495645

COCC(=O)Nc1csc(C=CC(=O)c2c(O)c3cccnc3n(C)c2=O)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.37
KDM4E B2RXH2 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
USP2 O75604 2/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
RXFP1 Q9HBX9 5/20 0.36
TP53 P04637 7/20 0.36
ALDH1A1 P00352 2/20 0.36
LMNA P02545 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NLRP3 Q96P20 1/20 0.36
EGFR P00533 1/20 0.35
SRC P12931 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
PADI4 Q9UM07 1/20 0.35
KCNA3 P22001 1/20 0.34

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
SCHEMBL13403049 1.00 MAPT (0.37) MAPTKDM4ENPC1RAB9AUSP2
SCHEMBL4520046 0.86 GAA (0.40) MAPTKDM4ENPC1RAB9AUSP2
SCHEMBL4522131 0.86 RXFP1 (0.41) MAPTRXFP1TP53ALDH1A1LMNA
SCHEMBL3495642 0.80 PADI4 (0.35) MAPTKDM4ENPC1RAB9AUSP2
SCHEMBL13402968 0.78 RAB9A (0.38) MAPTNPC1RAB9AHPGDALDH1A1
SCHEMBL3493934 0.78 RAB9A (0.38) MAPTNPC1RAB9AHPGDALDH1A1
SCHEMBL3495389 0.74 KDM4E (0.42) MAPTKDM4ENPC1RAB9AUSP2
SCHEMBL3495386 0.74 KDM4E (0.42) MAPTKDM4ENPC1RAB9AUSP2
SCHEMBL4523899 0.74 RXFP1 (0.38) MAPTKDM4ENPC1RAB9AUSP2
SCHEMBL4523900 0.74 RXFP1 (0.38) MAPTKDM4ENPC1RAB9AUSP2

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-20100081652-A1 Cinnamoyl Compound and Use Thereof SHIRAKI HIROAKI 2010-04-01 US disclosed
EP-1857455-A1 CINNAMOYL COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2007-11-21 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-20100081652-A1 Cinnamoyl Compound and Use Thereof COL2A1, MMP7, COL14A1 MAPT 4000/4885KDM4E 2703/4885NPC1 701/4885

“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.