SCHEMBL5064625

SCHEMBL5064625

Cc1ccsc1C1=Nc2cc(C(=O)NCc3cccs3)ccc2Sc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.52
TP53 P04637 3/20 0.51
CNR1 P21554 7/20 0.51
CNR2 P34972 1/20 0.51
LMNA P02545 4/20 0.50
POLB P06746 2/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.50
PLA2G1B P04054 2/20 0.49
ATG4B Q9Y4P1 2/20 0.49
HTT P42858 1/20 0.49
KDM4E B2RXH2 1/20 0.47

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
SCHEMBL5064738 0.90 CNR1 (0.49) MAPTTP53CNR1CNR2LMNA
SCHEMBL5058687 0.89 POLB (0.56) MAPTTP53CNR1CNR2LMNA
SCHEMBL5058775 0.87 TP53 (0.66) MAPTTP53CNR1CNR2LMNA
SCHEMBL5062640 0.87 LMNA (0.68) MAPTTP53CNR1CNR2LMNA
SCHEMBL5058689 0.87 LMNA (0.52) MAPTTP53CNR1CNR2LMNA
SCHEMBL5057192 0.86 CNR1 (0.53) MAPTTP53CNR1CNR2LMNA
SCHEMBL5058646 0.85 CNR1 (0.66) MAPTTP53CNR1CNR2LMNA
SCHEMBL14205980 0.85 TP53 (0.64) MAPTTP53CNR1CNR2LMNA
SCHEMBL5054123 0.85 CNR1 (0.71) MAPTTP53CNR1CNR2LMNA
SCHEMBL5054138 0.84 PKM (0.62) MAPTTP53CNR1CNR2LMNA

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 MAPT 3344/4885TP53 4870/4885CNR1 1/4885
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE CNR1, CNR2, FAAH MAPT 3344/4885TP53 4870/4885CNR1 1/4885

“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.