SCHEMBL5063131

SCHEMBL5063131

CCCCNC(=O)c1ccc2c(c1)N=C(c1ccc(Cl)s1)c1ccc(F)cc1S2

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.60
CNR2 P34972 2/20 0.60
TP53 P04637 6/20 0.52
SMN1; SMN2 Q16637 4/20 0.45
NPSR1 Q6W5P4 2/20 0.44
MAPT P10636 2/20 0.44
HTT P42858 2/20 0.44
PAX8 Q06710 2/20 0.44
PLA2G1B P04054 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
LMNA P02545 1/20 0.43
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.42
RAB9A P51151 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
SCHEMBL5057207 0.94 CNR1 (0.61) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL5063093 0.91 CNR1 (0.65) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL5064634 0.89 CNR1 (0.77) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL14205913 0.87 CNR1 (0.79) CNR1CNR2TP53SMN1; SMN2MAPT
SCHEMBL5058680 0.87 CNR1 (0.66) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL5054153 0.86 CNR1 (0.61) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL5064659 0.86 CNR1 (0.79) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL13808186 0.85 CNR1 (0.69) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL5064600 0.84 CNR1 (0.80) CNR1CNR2TP53SMN1; SMN2NPSR1
SCHEMBL13807924 0.83 CNR1 (0.61) CNR1CNR2TP53SMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2/4885TP53 4870/4885

“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.