SCHEMBL9975557

SCHEMBL9975557

C[C@H](CO)NC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.60
KCNK3 O14649 1/20 0.60
ALDH1A1 P00352 1/20 0.60
THRB P10828 1/20 0.60
BLM P54132 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
FAAH O00519 1/20 0.50

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
SCHEMBL9975568 0.86 CNR2 (0.60) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL9975563 0.78 FAAH (0.50) FAAH
SCHEMBL13151436 0.76 CNR2 (1.00) CNR2KCNK3ALDH1A1THRBBLM
Methanandamide SCHEMBL27775277 0.76 CNR2 (1.00) CNR2KCNK3ALDH1A1THRBBLM
Methanandamide SCHEMBL4236530 0.76 CNR2 (1.00) CNR2KCNK3ALDH1A1THRBBLM
Methanandamide SCHEMBL338871 0.76 CNR2 (1.00) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL14384955 0.76 CNR2 (0.74) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL9975595 0.75 CNR2 (0.58) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL22302422 0.71 CNR2 (0.67) CNR2KCNK3ALDH1A1THRBBLM
SCHEMBL22301829 0.71 CNR2 (0.86) CNR2KCNK3ALDH1A1THRBBLM

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202893-B2 Cannabinergic lipid ligands UNIVERSITY OF CONNECTICUT (US) 2012-06-19 US disclosed
US-8202893-B2 Cannabinergic lipid ligands UNIVERSITY OF CONNECTICUT (US) 2012-06-19 US disclosed
US-20090163557-A1 Cannabinergic Lipid Ligands NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-06-25 US disclosed
US-20090163557-A1 Cannabinergic Lipid Ligands NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2009-06-25 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-20090163557-A1 Cannabinergic Lipid Ligands FAAH, FAAH2, CNR2 CNR2 3/4885KCNK3 2154/4885ALDH1A1 2311/4885

“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.