SCHEMBL12083576

SCHEMBL12083576

CCCCCCCCCCC[C@@H](C)OC(=O)CN(C)C

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.58
CNR1 P21554 1/20 0.58
CNR2 P34972 1/20 0.58
ALDH1A1 P00352 1/20 0.46
MAPT P10636 1/20 0.45
LMNA P02545 2/20 0.44
NAAA Q02083 1/20 0.42
DNM1 Q05193 1/20 0.40
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
GPR84 Q9NQS5 3/20 0.39
FFAR1 O14842 1/20 0.39
CA1 P00915 1/20 0.39

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
SCHEMBL13847395 1.00 FAAH (0.58) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL30304049 0.85 FAAH (0.56) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL11370888 0.84 MAPT (0.47) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL25980986 0.84 FAAH (0.43) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL6906595 0.82 FAAH (0.65) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL8506453 0.82 FAAH (0.75) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL9986402 0.82 FAAH (0.65) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL9447664 0.82 FAAH (0.65) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL13126847 0.82 FAAH (0.65) FAAHCNR1CNR2ALDH1A1MAPT
SCHEMBL6339017 0.82 FAAH (0.65) FAAHCNR1CNR2ALDH1A1MAPT

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-8258321-B2 Beta-lactone compounds BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2012-09-04 US disclosed
US-20090124681-A1 BETA-LACTONE COMPOUNDS BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2009-05-14 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-20090124681-A1 BETA-LACTONE COMPOUNDS LBR, CYP8B1, GLB1 FAAH 442/4885CNR1 321/4885CNR2 888/4885

“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.