SCHEMBL5528741

SCHEMBL5528741

CC1CCCC(C(CN)P(=O)(O)O)C1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
ANPEP P15144 3/20 0.33
ERAP2 Q6P179 3/20 0.33
TP53 P04637 1/20 0.32
KDM4E B2RXH2 2/20 0.32
GMNN O75496 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
PMP22 Q01453 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX1 P07099 1/20 0.31
METAP1 P53582 1/20 0.30
FDPS P14324 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
SCHEMBL7176500 0.90 ANPEP (0.33) ANPEPERAP2EPHX1
SCHEMBL5529429 0.90 ANPEP (0.33) ANPEPERAP2EPHX1
SCHEMBL7176498 0.90 ANPEP (0.33) ANPEPERAP2EPHX1
SCHEMBL5394771 0.80 TP53 (0.45) ALDH1A1ANPEPERAP2TP53KDM4E
SCHEMBL5388081 0.78 TP53 (0.48) ALDH1A1ANPEPERAP2TP53KDM4E
SCHEMBL5394744 0.78 TP53 (0.48) ALDH1A1ANPEPERAP2TP53KDM4E
SCHEMBL6056274 0.77 ANPEP (0.37) ALDH1A1ANPEPERAP2
SCHEMBL6056283 0.77 ANPEP (0.37) ALDH1A1ANPEPERAP2
SCHEMBL5537099 0.77 ANPEP (0.37) ALDH1A1ANPEPERAP2
SCHEMBL8148562 0.74 ALDH1A1 (0.30) ALDH1A1

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-20070161706-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS WARNER-LAMBERT COMPANY LLC (US) 2007-07-12 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-20070161706-A1 PHARMACEUTICAL USES FOR ALPHA2DELTA LIGANDS ADRA2A, ADRA1D, OPRD1 ALDH1A1 268/4885ANPEP 2033/4885ERAP2 3008/4885

“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.