SCHEMBL699234

SCHEMBL699234

FC(F)(F)c1cccc(SCc2cc[c]cc2)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
DAO P14920 1/20 0.44
ADK P55263 2/20 0.43
GAA P10253 2/20 0.42
POLB P06746 1/20 0.42
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
MAPT P10636 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
IDO1 P14902 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
SCHEMBL3892638 0.85 ALDH1A1 (0.58) ALDH1A1KDM4EDAOADKGAA
SCHEMBL693637 0.84 DAO (0.53) KDM4EDAOTAAR1IDO1
SCHEMBL2556981 0.78 ADK (0.43) ALDH1A1KDM4EDAOADKGAA
SCHEMBL693198 0.77 XBP1 (0.48) ALDH1A1KDM4EGAAATML3MBTL1
SCHEMBL13319445 0.76 DAO (0.57) ALDH1A1KDM4EDAOTAAR1IDO1
SCHEMBL694408 0.76 MAOA (0.44) ALDH1A1DAOADKGAAPOLB
SCHEMBL27722503 0.74 KDM4E (0.53) ALDH1A1KDM4EDAOGAAPOLB
SCHEMBL1712262 0.74 MAOA (0.53) ALDH1A1KDM4EPOLBSLC6A4
SCHEMBL145568 0.73 TAAR1 (0.51) ALDH1A1KDM4EDAOGAATAAR1
SCHEMBL10494902 0.73 KDM4E (0.46) ALDH1A1KDM4EGAAPOLBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2421851-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2012-02-29 EP claimed
WO-2010124102-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO claimed
EP-2421851-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica, N.V. (BE) 2012-02-29 EP disclosed
EP-2421847-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS Janssen Pharmaceutica N.V. (BE) 2012-02-29 EP disclosed
WO-2010124102-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed
WO-2010124116-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2010-10-28 WO disclosed