SCHEMBL17359335

SCHEMBL17359335

CCC1CCC(C(=O)NCCCCCCNCCCC(=O)O)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.49
GNAI3 P08754 3/20 0.46
GNAO1 P09471 3/20 0.46
GNAI1 P63096 3/20 0.46
ADRA1A P35348 1/20 0.41
PRMT1 Q99873 1/20 0.40
EPHX1 P07099 1/20 0.40
PLA2G2A P14555 1/20 0.39
PLA2G4A P47712 1/20 0.39
ITGB3 P05106 1/20 0.39
ITGA2B P08514 1/20 0.39
FOLH1 Q04609 3/20 0.39
EPHX2 P34913 2/20 0.38
PRCP P42785 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL7538667 0.82 NAAA (0.71) NAAAGNAI3GNAO1GNAI1EPHX1
SCHEMBL9830399 0.82 PRMT1 (0.59) NAAAGNAI3GNAO1GNAI1ADRA1A
SCHEMBL2331473 0.82 EPHX2 (0.51) NAAAGNAI3GNAO1GNAI1ADRA1A
SCHEMBL24930537 0.81 NAAA (0.53) NAAAGNAI3GNAO1GNAI1PRCP
SCHEMBL7740128 0.81 NAAA (0.49) NAAAGNAI3GNAO1GNAI1PLA2G4A
SCHEMBL7740129 0.81 NAAA (0.49) NAAAGNAI3GNAO1GNAI1PLA2G4A
SCHEMBL16864015 0.79 EPHX2 (0.50) NAAAGNAI3GNAO1GNAI1EPHX2
SCHEMBL13618531 0.78 ADRA1A (0.51) NAAAGNAI3GNAO1GNAI1ADRA1A
SCHEMBL7739813 0.77 NAAA (0.46) NAAAGNAI3GNAO1GNAI1ADRA1A
SCHEMBL7739816 0.77 NAAA (0.46) NAAAGNAI3GNAO1GNAI1ADRA1A

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-20150366968-A1 PSMA LIGANDS AND USES THEREOF CASE WESTERN RESERVE UNIVERSITY 2015-12-24 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-20150366968-A1 PSMA LIGANDS AND USES THEREOF FOLH1, PSMA5, PSMA7 NAAA 2112/4885GNAI3 1044/4885GNAO1 2191/4885

“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.