SCHEMBL4476866

SCHEMBL4476866

Cc1cccc(CN[C@H]2CCC[C@H]2C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.47
BACE1 P56817 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
BCHE P06276 1/20 0.45
LMNA P02545 2/20 0.45
GRM2 Q14416 1/20 0.44
GRM3 Q14832 1/20 0.44
NPC1 O15118 1/20 0.44
SSTR3 P32745 3/20 0.44
OPRK1 P41145 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
MMP13 P45452 1/20 0.41

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
SCHEMBL13712272 0.87 ALDH1A1 (0.45) ACHEBACE1KDM4EALDH1A1BCHE
SCHEMBL5394785 0.84 HPGD (0.51) ALDH1A1GRM2GRM3SSTR3
SCHEMBL5384594 0.84 HPGD (0.51) ALDH1A1GRM2GRM3SSTR3
SCHEMBL372599 0.84 HPGD (0.51) ALDH1A1GRM2GRM3SSTR3
SCHEMBL4485053 0.80 SSTR3 (0.47) SSTR3MMP13
SCHEMBL26641160 0.76 ACHE (0.49) ACHEBACE1KDM4EALDH1A1BCHE
SCHEMBL14415190 0.76 ALDH1A1 (0.49) KDM4EALDH1A1NPC1SSTR3
SCHEMBL14492276 0.75 ACHE (0.65) ACHEBACE1KDM4EALDH1A1BCHE
SCHEMBL4480119 0.75 SSTR3 (0.63) KDM4ESSTR3
SCHEMBL2500840 0.75 SSTR3 (0.59) KDM4EALDH1A1LMNANPC1SSTR3

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-7582626-B2 5,6-dihydro-1H-pyridin-2-one compounds ANADYS PHARMACEUTICALS, INC. (US) 2009-09-01 US disclosed
US-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. 2009-04-30 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-20090111798-A1 5,6-DIHYDRO-1H-PYRIDIN-2-ONE COMPOUNDS HAVCR2, PYGL, HCCS ACHE 1582/4885BACE1 2026/4885KDM4E 2489/4885

“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.