SCHEMBL8212751

SCHEMBL8212751

CCCCNS(=O)(=O)c1ccc2c(c1)N=C(c1ccccc1)c1ccncc1S2

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.45
MAPT P10636 1/20 0.45
CNR1 P21554 4/20 0.45
RXRA P19793 1/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.41
TP53 P04637 2/20 0.41
CNR2 P34972 2/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
BRD4 O60885 1/20 0.39
NAMPT P43490 1/20 0.38

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
SCHEMBL5058677 0.83 CNR1 (0.66) MAPTCNR1RXRASMN1; SMN2NPSR1
SCHEMBL14205655 0.80 CNR1 (0.54) MAPTCNR1RXRALMNAHTT
SCHEMBL13807777 0.77 CNR1 (0.51) MAPTCNR1RXRALMNAHTT
SCHEMBL13807947 0.77 CNR1 (0.41) POLBMAPTCNR1RXRALMNA
SCHEMBL13807944 0.77 CNR1 (0.46) POLBMAPTCNR1RXRATP53
SCHEMBL14043580 0.76 TP53 (0.58) POLBMAPTCNR1LMNAHTT
SCHEMBL14043678 0.74 CNR1 (0.47) MAPTCNR1RXRALMNAHTT
SCHEMBL13808180 0.71 CNR1 (0.44) MAPTCNR1RXRALMNAHTT
SCHEMBL8211812 0.69 CNR1 (0.62) POLBMAPTCNR1LMNAHTT
SCHEMBL8213532 0.69 MAPT (0.39) POLBMAPTCNR1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008048648-A2 CB1-MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-24 WO disclosed