SCHEMBL5057569

SCHEMBL5057569

CC(C)CNC(=O)c1ccc2c(c1)N=C(c1ccc(Cl)cn1)c1ccc(Cl)cc1S2

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 8/20 0.63
TP53 P04637 4/20 0.47
CNR2 P34972 2/20 0.45
MAPT P10636 4/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
LMNA P02545 1/20 0.43
PLA2G1B P04054 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HPGD P15428 1/20 0.42
NPC1 O15118 1/20 0.41
ALPL P05186 1/20 0.41

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
SCHEMBL5064679 0.93 CNR1 (0.57) CNR1TP53CNR2MAPTKDM4E
SCHEMBL5058767 0.87 CNR1 (0.72) CNR1TP53CNR2MAPTKDM4E
SCHEMBL5057594 0.86 CNR1 (0.65) CNR1TP53CNR2MAPTKDM4E
SCHEMBL5057662 0.84 CNR1 (0.82) CNR1TP53CNR2MAPTKDM4E
SCHEMBL14043747 0.81 CNR1 (0.42) CNR1TP53CNR2MAPTKDM4E
SCHEMBL14206002 0.81 CNR1 (0.64) CNR1TP53CNR2KDM4EALDH1A1
SCHEMBL14043694 0.81 CNR1 (0.62) CNR1TP53CNR2MAPTLMNA
SCHEMBL14206007 0.81 CNR1 (0.77) CNR1TP53CNR2MAPTKDM4E
SCHEMBL13807924 0.80 CNR1 (0.61) CNR1TP53CNR2MAPTLMNA
SCHEMBL5058659 0.80 CNR1 (0.65) CNR1TP53CNR2MAPTSMN1; 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 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 1/4885TP53 4870/4885CNR2 2/4885

“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.