SCHEMBL13801504

SCHEMBL13801504

CCNC(=O)c1cc(=O)n(CC)c(=O)n1PC

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
PIK3CA P42336 1/20 0.35
POLB P06746 2/20 0.34
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 3/20 0.34
HPGD P15428 1/20 0.34
MAPT P10636 3/20 0.33
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.31
BRD4 O60885 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ACSS2 Q9NR19 1/20 0.31
TSHR P16473 1/20 0.30
HTT P42858 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL13801507 0.89 POLB (0.33) KDM4EPOLBALDH1A1HSD17B10MAPT
SCHEMBL13801505 0.87 ALDH1A1 (0.36) KDM4EPOLBALDH1A1HSD17B10HPGD
SCHEMBL8279984 0.82 GPR35 (0.40) KDM4EPOLBALDH1A1HSD17B10HPGD
SCHEMBL9008078 0.73 POLB (0.47) KDM4EPOLBALDH1A1MAPTLMNA
SCHEMBL9008105 0.72 NPSR1 (0.41) KDM4EPOLBALDH1A1HSD17B10HPGD
SCHEMBL9008171 0.70 POLB (0.37) KDM4EPOLBALDH1A1MAPTL3MBTL1
SCHEMBL9008121 0.70 ALDH1A1 (0.38) KDM4EPOLBALDH1A1HPGDMAPT
SCHEMBL9008083 0.70 POLB (0.37) KDM4EPOLBALDH1A1MAPTLMNA
SCHEMBL8279983 0.68 POLB (0.35) KDM4EPOLBALDH1A1L3MBTL1
SCHEMBL12690123 0.66 GPR84 (0.35) POLBALDH1A1LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163505-A1 AMINO-HETEROARYL-CONTAINING PROKINETICIN 1 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA NV (BE) 2009-06-25 US 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-20090163505-A1 AMINO-HETEROARYL-CONTAINING PROKINETICIN 1 RECEPTOR ANTAGONISTS PROKR1, PROKR2, GIPR KDM4E 4839/4885PIK3CA 3809/4885POLB 4287/4885

“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.