SCHEMBL3934237

SCHEMBL3934237

O=S(=O)(c1cccs1)N1CCc2c(ccnc2Nc2cnc3ccccc3c2)C1

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FAAH O00519 10/20 0.76
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
MKNK1 Q9BUB5 8/20 0.45
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL3931080 0.87 FAAH (0.75) FAAHMAPK1MKNK1ALDH1A1
SCHEMBL3941135 0.86 FAAH (1.00) FAAHMAPK1ALDH1A1
SCHEMBL3933627 0.86 FAAH (0.73) FAAHTSHRMAPK1MKNK1ALDH1A1
SCHEMBL3931485 0.86 FAAH (0.73) FAAHTSHRMAPK1MKNK1ALDH1A1
SCHEMBL3937438 0.86 FAAH (0.73) FAAHTSHRMAPK1MKNK1ALDH1A1
SCHEMBL3932389 0.85 FAAH (0.72) FAAHMAPK1MKNK1ALDH1A1
SCHEMBL3934554 0.85 FAAH (0.72) FAAHTSHRMAPK1MKNK1ALDH1A1
SCHEMBL3931338 0.85 FAAH (0.79) FAAHMAPK1MKNK1ALDH1A1
SCHEMBL3934758 0.85 FAAH (0.80) FAAHMAPK1ALDH1A1
SCHEMBL3942978 0.85 FAAH (0.86) FAAHTSHRMAPK1ALDH1A1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed
WO-2009011904-A1 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2009-01-22 WO disclosed