SCHEMBL4523899

SCHEMBL4523899

COCCOC(=O)Nc1cccc(/C=C/C(=O)c2c(O)c3cccnc3n(C)c2=O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 2/20 0.38
EGFR P00533 1/20 0.38
SRC P12931 1/20 0.38
HDAC4 P56524 1/20 0.38
MEF2D Q14814 1/20 0.38
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 3/20 0.36
TP53 P04637 3/20 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
MAPT P10636 5/20 0.36
USP2 O75604 2/20 0.36
HPGD P15428 1/20 0.36
XBP1 P17861 1/20 0.36
HTT P42858 1/20 0.35

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
SCHEMBL4523900 1.00 RXFP1 (0.38) RXFP1EGFRSRCHDAC4MEF2D
SCHEMBL4522131 0.88 RXFP1 (0.41) RXFP1EGFRSRCHDAC4MEN1
SCHEMBL4510491 0.82 KDM4E (0.39) KDM4ETP53ALDH1A1MAPTHPGD
SCHEMBL4510487 0.82 KDM4E (0.39) KDM4ETP53ALDH1A1MAPTHPGD
SCHEMBL2280461 0.81 RAB9A (0.48) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL2280459 0.81 RAB9A (0.48) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL4510109 0.79 CYSLTR2 (0.44) ALDH1A1LMNA
SCHEMBL4510106 0.79 CYSLTR2 (0.44) ALDH1A1LMNA
SCHEMBL4520684 0.79 NQO1 (0.42) KDM4EALDH1A1LMNA
SCHEMBL4520688 0.79 NQO1 (0.42) KDM4EALDH1A1LMNA

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-20090143368-A1 Use of Cinnamoyl Compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-04 US disclosed
EP-1857104-A1 USE OF CINNAMOYL COMPOUND 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-20090143368-A1 Use of Cinnamoyl Compound COL2A1, COL1A1, SMAD2 RXFP1 1117/4885EGFR 1584/4885SRC 1320/4885

“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.