SCHEMBL4512628

SCHEMBL4512628

COCCNC(=O)c1cccc(C=CC(=O)c2c(O)c3cccnc3[nH]c2=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PADI4 Q9UM07 3/20 0.43
CCNK O75909 1/20 0.39
CDK12 Q9NYV4 1/20 0.39
CYP1A2 P05177 3/20 0.39
CYP1A1 P04798 2/20 0.39
CYP1B1 Q16678 2/20 0.39
FGFR1 P11362 1/20 0.39
PDGFRA P16234 1/20 0.39
FLT1 P17948 1/20 0.39
KDR P35968 1/20 0.39
BRD4 O60885 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
SLC40A1 Q9NP59 1/20 0.39
P4HB P07237 2/20 0.38
LOX P28300 2/20 0.38
LOXL2 Q9Y4K0 2/20 0.38
HPGD P15428 3/20 0.38
CYP2C19 P33261 1/20 0.38
NQO1 P15559 1/20 0.37

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
SCHEMBL4512621 1.00 PADI4 (0.43) PADI4CCNKCDK12CYP1A2CYP1A1
SCHEMBL2277539 0.87 MEN1 (0.49) PADI4FGFR1PDGFRAFLT1KDR
SCHEMBL2277535 0.87 MEN1 (0.49) PADI4FGFR1PDGFRAFLT1KDR
SCHEMBL13818116 0.84 NQO1 (0.48) CYP1A2CYP1A1CYP1B1CYP3A4CYP2D6
SCHEMBL4510487 0.83 KDM4E (0.39) CYP1A2BRD4SLC40A1P4HBLOX
SCHEMBL4510491 0.83 KDM4E (0.39) CYP1A2BRD4SLC40A1P4HBLOX
SCHEMBL13818097 0.83 PADI4 (0.40) PADI4CCNKCDK12CYP1A2CYP1B1
SCHEMBL13818144 0.82 TP53 (0.38) CYP1A2CYP1A1CYP1B1BRD4CYP3A4
SCHEMBL2280689 0.80 LMNA (0.43) CYP1A2P4HBHPGDCYP2C19MEN1
SCHEMBL2280683 0.80 LMNA (0.43) CYP1A2P4HBHPGDCYP2C19MEN1

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 PADI4 4647/4885CCNK 655/4885CDK12 1777/4885

“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.