SCHEMBL5058659

SCHEMBL5058659

CC(C)CNC(=O)c1ccc2c(c1)N=C(c1ccc(Cl)cc1)c1ccc(F)cc1S2

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 11/20 0.65
CNR2 P34972 2/20 0.53
MAPT P10636 2/20 0.45
TP53 P04637 5/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.42

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
SCHEMBL5058767 0.93 CNR1 (0.72) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL13808050 0.89 CNR1 (0.51) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL13808250 0.88 CNR1 (0.83) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL5064679 0.88 CNR1 (0.57) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL13808167 0.88 CNR1 (0.57) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL5064659 0.86 CNR1 (0.79) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL13808249 0.86 CNR1 (0.74) CNR1CNR2TP53SMN1; SMN2
SCHEMBL14205913 0.86 CNR1 (0.79) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL5577088 0.84 CNR1 (0.59) CNR1CNR2MAPTTP53SMN1; SMN2
SCHEMBL5064748 0.82 CNR1 (0.79) CNR1CNR2MAPTTP53SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009075691-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2009-06-18 WO disclosed
WO-2008118141-A2 USE OF CANNABINOID MODULATING COMPOUNDS IN COMBINATION WITH OTHER THERAPEUTIC COMPOUNDS FOR ADJUNCTIVE THERAPY ACADIA PHARMACEUTICALS INC. (US) 2008-10-02 WO disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 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-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE CNR1, CNR2, FAAH CNR1 1/4885CNR2 2/4885MAPT 3344/4885

“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.