SCHEMBL5058677

SCHEMBL5058677

CCCCNS(=O)(=O)c1ccc2c(c1)N=C(c1ccc(Cl)cc1)c1ccccc1S2

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.66
CNR2 P34972 2/20 0.54
TP53 P04637 4/20 0.45
RXRA P19793 1/20 0.43
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 2/20 0.39
HRH4 Q9H3N8 1/20 0.38
PLEC Q15149 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL14205655 0.91 CNR1 (0.54) CNR1CNR2TP53RXRAMAPT
SCHEMBL13807777 0.88 CNR1 (0.51) CNR1CNR2TP53RXRAALDH1A1
SCHEMBL8212751 0.83 POLB (0.45) CNR1CNR2TP53RXRAMAPT
SCHEMBL13807944 0.82 CNR1 (0.46) CNR1CNR2TP53RXRAALDH1A1
SCHEMBL14043580 0.82 TP53 (0.58) CNR1CNR2TP53ALDH1A1GAA
SCHEMBL14043678 0.82 CNR1 (0.47) CNR1CNR2TP53RXRAALDH1A1
SCHEMBL4637626 0.79 CNR1 (1.00) CNR1CNR2TP53ALDH1A1GAA
SCHEMBL8204959 0.79 CNR1 (0.43) CNR1CNR2TP53RXRAALDH1A1
SCHEMBL13808180 0.78 CNR1 (0.44) CNR1CNR2TP53RXRAALDH1A1
SCHEMBL4746911 0.77 CNR1 (0.48) CNR1CNR2ALDH1A1GAAMAPT

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 9 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
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
WO-2007047737-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2007-04-26 WO 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 (2 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-20070105819-A1 CB-1 modulating compounds and their use CNR1, CNR2, FAAH CNR1 1/4885CNR2 2/4885TP53 4870/4885
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.