SCHEMBL20009184

SCHEMBL20009184

CCCN1C[C@@H]2C[C@H](O)CC[C@@H]2C1=O

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.37
CYP3A4 P08684 2/20 0.36
MAPT P10636 2/20 0.36
ADORA1 P30542 2/20 0.32
PER2 O15055 1/20 0.32
CRY2 Q49AN0 1/20 0.32
ADORA2A P29274 1/20 0.31

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
SCHEMBL20009181 0.86 PER2 (0.32) PER2CRY2
SCHEMBL20009180 0.77 CYP3A4 (0.32) CYP3A4PER2CRY2
SCHEMBL29312341 0.67 SMN1; SMN2 (0.38)
SCHEMBL14218297 0.65 LMNA (0.37)
SCHEMBL24909957 0.64 FKBP1A (0.39) GBA1MAPT
SCHEMBL12251961 0.64 APEX1 (0.55) GBA1
SCHEMBL12252004 0.64 FKBP1A (0.39) GBA1MAPT
SCHEMBL179075 0.62 GAA (0.34) PER2
SCHEMBL29348317 0.62 PER2 (0.34) PER2
SCHEMBL9068590 0.62 L3MBTL1 (0.36)

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-20180086762-A1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2018-03-29 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-20180086762-A1 BETA-LACTAMASE INHIBITORS MGAM, LCT, GAA GBA1 39/4885CYP3A4 786/4885MAPT 1557/4885

“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.